actives_5ht3.sdf

tpls\mol-1.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
    1.1200   -0.6200   -1.0800 C   0  0  3
    1.5400    0.8200   -1.0600 N   0  0  0
   -0.4200   -0.6400   -1.3200 C   0  0  0
    1.5600   -1.1800    0.3000 C   0  0  0
    1.1400    1.2200    0.3200 C   0  0  3
    2.9600    1.0600   -1.3800 C   0  0  0
   -1.2400    0.2400   -0.3000 C   0  0  0
    1.5600    0.0600    1.2400 C   0  0  0
   -0.4200    1.4600    0.2600 C   0  0  0
   -1.7800   -0.5600    0.7600 N   0  0  0
   -2.6400   -0.1600    1.7400 C   0  0  0
   -3.0600   -1.0400    2.6800 N   0  0  0
   -3.0200    1.0000    1.7600 O   0  0  0
   -3.9400   -0.9400    3.7800 C   0  0  0
   -4.2000   -2.0200    4.6000 C   0  0  0
   -4.7400    0.5200    4.2000 S   0  0  0
   -5.1000   -1.6400    5.6200 C   0  0  0
   -3.7000   -3.1800    4.4200 O   0  0  0
   -5.4600   -0.3200    5.5200 C   0  0  0
   -3.7800   -4.3600    5.0400 C   0  0  0
  1  2  1
  1  3  1
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 16 19  1
 18 20  1
  5  8  1
  7  9  1
 17 19  2
M  END
$$$$
tpls\mol-10.tpl
XXCombChem10310515113D                 0.00000

 32 36  0  0  1  0999 V2000
    8.5220    9.3420    4.5410 C   0  0  0
    9.4410   10.3480    4.8890 C   0  0  0
    8.1880    8.6800    5.7200 C   0  0  0
    8.1050    9.1540    3.2070 C   0  0  0
    9.6630   10.3020    6.2310 N   0  0  0
    9.9510   11.1780    3.8640 C   0  0  0
    8.9140    9.3300    6.6410 N   0  0  0
    7.3480    7.6190    6.0310 C   0  0  0
    8.6210    9.9910    2.2010 C   0  0  0
   10.4260   11.0340    7.0810 C   0  0  0
    9.5440   11.0020    2.5280 C   0  0  0
    7.1740    7.1220    7.2690 N   0  0  0
    6.7350    7.1130    5.1000 O   0  0  0
   10.6660   10.9260    8.4750 C   0  0  0
   10.9960   11.9620    6.5210 O   0  0  0
    6.3410    6.0370    7.7280 C   0  0  1
   11.4410   11.8960    9.1780 C   0  0  0
   10.1810    9.8680    9.2910 C   0  0  0
    7.1900    4.8540    8.2990 C   0  0  0
    5.2440    6.5290    8.7300 C   0  0  0
   11.7010   11.8350   10.5590 C   0  0  0
   10.4230    9.7780   10.6750 C   0  0  0
    7.3460    4.8500    9.8520 C   0  0  2
    5.6060    6.3490   10.2370 C   0  0  1
   11.1850   10.7690   11.3110 C   0  0  0
    6.0300    4.9590   10.5240 N   0  0  0
    8.0280    6.0870   10.4800 C   0  0  0
    6.8720    7.0830   10.7370 C   0  0  0
    5.0640    3.8370   10.5230 C   0  0  0
    7.8770    3.9430   10.1580 H   0  0  0
    4.7470    6.6390   10.8510 H   0  0  0
    5.8000    5.6320    6.8660 H   0  0  0
  1  2  1
  1  3  1
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  2  5  1
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  3  8  1
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  8 12  1
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 21 25  1
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 26 29  1
  5  7  1
  9 11  2
 22 25  2
 24 26  1
 27 28  1
 23 30  1
 24 31  1
 16 32  1
M  END
$$$$
tpls\mol-100.tpl
XXCombChem10310515113D                 0.00000

 25 28  0  0  1  0999 V2000
    5.0160    6.8380    7.2530 N   0  0  0
    4.3190    7.2640    6.0420 C   0  0  1
    6.3690    6.6230    7.2940 C   0  0  0
    4.3110    6.6410    8.3990 C   0  0  0
    4.6830    8.7210    5.5880 C   0  0  0
    4.2990    6.1730    4.9130 C   0  0  0
    7.0390    6.2140    8.4590 C   0  0  0
    7.0530    6.7860    6.2900 O   0  0  0
    4.8860    6.2570    9.5240 N   0  0  0
    4.8160    8.9320    4.0480 C   0  0  2
    4.4820    6.7080    3.4590 C   0  0  1
    6.2260    6.0330    9.6060 C   0  0  0
    8.4260    5.9700    8.5900 C   0  0  0
    3.9060    8.0600    3.2690 N   0  0  0
    6.1660    8.4800    3.4420 C   0  0  0
    5.9440    7.0050    3.0520 C   0  0  0
    6.7870    5.6240   10.8300 C   0  0  0
    8.9920    5.5600    9.8150 C   0  0  0
    2.4440    8.2830    3.2570 C   0  0  0
    8.1750    5.3800   10.9610 C   0  0  0
   10.6710    5.3050    9.8220 Cl  0  0  0
    8.6580    4.9850   12.1760 N   0  0  0
    3.2450    7.3720    6.2460 H   0  0  0
    4.6600    9.9890    3.8080 H   0  0  0
    4.0580    5.9900    2.7500 H   0  0  0
  2  1  1
  1  3  1
  1  4  1
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  3  7  1
  3  8  2
  4  9  2
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 17 20  1
 18 21  1
 20 22  1
  9 12  1
 11 14  1
 15 16  1
 18 20  2
  2 23  1
 10 24  1
 11 25  1
M  END
$$$$
tpls\mol-101.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
    6.1390    7.9560    6.1920 C   0  0  1
    6.7090    6.6110    6.2020 N   0  0  0
    5.6670    8.4270    4.7720 C   0  0  0
    5.1430    8.2250    7.3750 C   0  0  0
    5.9610    5.4860    5.9650 C   0  0  0
    8.0350    6.4450    6.4560 C   0  0  0
    4.3420    9.2500    4.7430 C   0  0  2
    3.8850    9.0740    7.0150 C   0  0  1
    6.5100    4.1930    5.9750 C   0  0  0
    4.7620    5.5780    5.7310 O   0  0  0
    8.6040    5.2540    6.4780 N   0  0  0
    4.1540   10.0760    5.9580 N   0  0  0
    3.0480    8.4060    4.8170 C   0  0  0
    2.7450    8.2890    6.3250 C   0  0  0
    7.8980    4.1140    6.2470 C   0  0  0
    5.8190    2.9830    5.7420 C   0  0  0
    4.9880   11.2700    6.2180 C   0  0  0
    8.5500    2.8680    6.2820 C   0  0  0
    6.4760    1.7340    5.7770 C   0  0  0
    7.8700    1.6440    6.0500 C   0  0  0
    5.4640    0.4040    5.4710 Cl  0  0  0
    8.5860    0.4660    6.1020 N   0  3  0
    8.1380   -0.6350    5.9270 O   0  0  0
    9.7680    0.3850    6.3330 O   0  5  0
    6.9220    8.6960    6.4070 H   0  0  0
    4.3110    9.8610    3.8350 H   0  0  0
    3.4900    9.5440    7.9210 H   0  0  0
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  4  8  1
  5  9  1
  5 10  2
  6 11  2
  7 12  1
  7 13  1
  8 14  1
  9 15  1
  9 16  2
 12 17  1
 15 18  2
 16 19  1
 18 20  1
 19 21  1
 20 22  1
  8 12  1
 11 15  1
 13 14  1
 19 20  2
  1  2  1
  1  3  1
 22 23  2
 22 24  1
  1 25  1
  7 26  1
  8 27  1
M  END
$$$$
tpls\mol-102.tpl
XXCombChem10310515113D                 0.00000

 28 31  0  0  1  0999 V2000
    4.6150    6.9660    3.4170 C   0  0  1
    4.9580    7.4980    4.7280 N   0  0  0
    5.4170    7.4490    2.1600 C   0  0  0
    4.4140    5.4130    3.3200 C   0  0  0
    4.2180    7.3450    5.8660 C   0  0  0
    6.0430    8.2500    4.8260 N   0  0  0
    6.5890    6.5400    1.6840 C   0  0  2
    5.5550    4.5460    2.7040 C   0  0  1
    4.6180    7.9100    7.0880 C   0  0  0
    3.1600    6.7280    5.8350 O   0  0  0
    6.4880    8.8210    5.9040 N   0  0  0
    5.9870    5.1950    1.4300 N   0  0  0
    7.8530    6.4110    2.5880 C   0  0  0
    6.7920    4.2570    3.6020 C   0  0  0
    5.8120    8.6720    7.0740 C   0  0  0
    3.9350    7.7930    8.3190 C   0  0  0
    6.5780    4.3510    0.3600 C   0  0  0
    7.7010    5.4890    3.8290 C   0  0  0
    6.2900    9.2800    8.2480 C   0  0  0
    4.4170    8.4020    9.4980 C   0  0  0
    5.6170    9.1670    9.4920 C   0  0  0
    3.4490    8.1350   10.8690 Cl  0  0  0
    6.1550    9.7930   10.5980 N   0  3  0
    5.6910    9.7800   11.7060 O   0  0  0
    7.1720   10.4430   10.5980 O   0  5  0
    3.6250    7.4170    3.2710 H   0  0  0
    6.9250    6.9870    0.7420 H   0  0  0
    5.1030    3.5710    2.4880 H   0  0  0
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  4  8  1
  5  9  1
  5 10  2
  6 11  2
  7 12  1
  7 13  1
  8 14  1
  9 15  1
  9 16  2
 12 17  1
 13 18  1
 15 19  2
 16 20  1
 19 21  1
 20 22  1
 21 23  1
  8 12  1
 11 15  1
 14 18  1
 20 21  2
  1  2  1
  1  3  1
 23 24  2
 23 25  1
  1 26  1
  7 27  1
  8 28  1
M  END
$$$$
tpls\mol-103.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    4.7810    7.0680    5.6280 N   0  0  0
    5.1460    7.2210    4.2270 C   0  0  1
    3.8720    7.8340    6.3000 C   0  0  0
    5.3210    6.0640    6.3020 N   0  0  0
    5.7050    8.6230    3.7960 C   0  0  0
    5.9970    6.1050    3.5310 C   0  0  0
    3.5680    7.6040    7.6510 C   0  0  0
    3.2740    8.7320    5.7210 O   0  0  0
    5.0980    5.7640    7.5460 N   0  0  0
    7.2420    8.7870    3.5880 C   0  0  2
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    2.6590    8.3520    8.4350 C   0  0  0
    7.7140    7.6460    2.7460 N   0  0  0
    8.1230    8.9090    4.8640 C   0  0  0
    8.3660    6.3150    4.7710 C   0  0  0
    3.9910    6.1980    9.6240 C   0  0  0
    2.4170    8.0400    9.7900 C   0  0  0
    8.9230    7.8300    1.9040 C   0  0  0
    8.2600    7.5870    5.6580 C   0  0  0
    3.0850    6.9510   10.4070 C   0  0  0
    1.3020    9.0280   10.6040 Cl  0  0  0
    2.8960    6.5950   11.7120 N   0  0  0
    4.1620    7.1190    3.7520 H   0  0  0
    7.3680    9.7280    3.0410 H   0  0  0
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  2  1  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  2
  5 10  1
  6 11  1
  7 12  1
  7 13  2
 10 14  1
 10 15  1
 11 16  1
 12 17  2
 13 18  1
 14 19  1
 15 20  1
 17 21  1
 18 22  1
 21 23  1
  9 12  1
 11 14  1
 16 20  1
 18 21  2
  2 24  1
 10 25  1
 11 26  1
M  END
$$$$
tpls\mol-104.tpl
XXCombChem10310515113D                 0.00000

 25 28  0  0  1  0999 V2000
    4.1400    4.5600    4.2000 C   0  0  2
    4.0400    6.0000    4.0000 N   0  0  0
    5.1400    3.8400    3.2400 C   0  0  1
    2.7600    3.8200    4.2200 C   0  0  0
    5.0800    6.8600    4.1400 C   0  0  0
    2.8400    6.4800    3.6800 N   0  0  0
    5.3200    2.4600    3.7800 N   0  0  0
    4.6400    3.6000    1.7800 C   0  0  0
    2.9200    2.2600    4.2400 C   0  0  0
    4.8800    8.2400    3.9200 C   0  0  0
    6.2000    6.4600    4.4200 O   0  0  0
    2.6000    7.7400    3.4800 N   0  0  0
    4.1000    1.7800    3.3200 C   0  0  1
    6.6000    1.8000    3.4200 C   0  0  0
    3.9400    2.2200    1.8400 C   0  0  0
    3.5800    8.6600    3.5800 C   0  0  0
    5.9000    9.2200    4.0200 C   0  0  0
    3.3000   10.0200    3.3400 C   0  0  0
    5.6400   10.5800    3.8000 C   0  0  0
    4.3200   10.9800    3.4600 C   0  0  0
    7.0600   11.7800    3.9600 Br  0  0  0
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    4.5400    4.3800    5.2200 H   0  0  0
    6.0800    4.4200    3.2200 H   0  0  0
    4.1800    0.6800    3.4000 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  3  8  1
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  5 11  2
  6 12  2
 13  7  1
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 18 20  1
 19 21  1
 20 22  1
  9 13  1
 12 16  1
 13 15  1
 19 20  2
  1 23  1
  3 24  1
 13 25  1
M  END
$$$$
tpls\mol-105.tpl
XXCombChem10310515113D                 0.00000

 22 25  0  0  1  0999 V2000
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    0.1400   -1.2000   -0.3400 C   0  0  3
    0.0400    1.2200    0.5200 C   0  0  0
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    1.3800   -1.4600    0.5800 C   0  0  0
    1.5200    1.0400    0.0400 C   0  0  3
   -4.4200   -0.5600   -0.4000 C   0  0  0
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    1.5400    0.6000   -1.4000 N   0  0  0
    2.1600   -0.1400    0.8600 C   0  0  0
   -4.5000    0.4000   -1.4400 C   0  0  0
   -5.6000   -1.2600   -0.0400 C   0  0  0
    1.3600    1.7000   -2.3800 C   0  0  0
   -5.7200    0.6400   -2.1000 C   0  0  0
   -6.8200   -1.0200   -0.7000 C   0  0  0
   -6.8800   -0.0600   -1.7400 C   0  0  0
   -8.2200   -1.8600   -0.2600 Cl  0  0  0
   -0.8800   -0.4800    1.4000 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
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  3  8  1
  4  9  1
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 16 19  1
 18 20  1
 19 21  1
  9 13  1
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 12 15  1
 19 20  2
  1 22  1
M  END
$$$$
tpls\mol-106.tpl
XXCombChem10310515113D                 0.00000

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    0.1400   -1.2000   -0.3400 C   0  0  3
    0.0400    1.2200    0.5200 C   0  0  0
   -3.1800   -0.7400    0.2200 C   0  0  0
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    0.7200   -0.6200   -1.6800 C   0  0  0
    1.3800   -1.4600    0.5800 C   0  0  0
    1.5200    1.0400    0.0400 C   0  0  3
   -4.4200   -0.5600   -0.4000 C   0  0  0
   -3.0800   -1.5600    1.1200 O   0  0  0
   -3.3800    1.0800   -1.8000 N   0  0  0
    1.5400    0.6000   -1.4000 N   0  0  0
    2.1600   -0.1400    0.8600 C   0  0  0
   -4.5000    0.4000   -1.4400 C   0  0  0
   -5.6000   -1.2600   -0.0400 C   0  0  0
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   -5.7200    0.6400   -2.1000 C   0  0  0
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   -8.0400    0.2000   -2.4200 N   0  0  0
   -0.8800   -0.4800    1.4000 H   0  0  0
  1  2  1
  1  3  1
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  2  5  1
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  9 13  1
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 19 20  2
  1 23  1
M  END
$$$$
tpls\mol-107.tpl
XXCombChem10310515113D                 0.00000

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    6.8200    3.2000    2.2400 C   0  0  0
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    3.3400    2.9000    5.2000 C   0  0  0
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    8.9600    2.3400    1.3000 C   0  0  0
    8.0000   -0.2800    1.7000 C   0  0  0
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M  END
$$$$
tpls\mol-108.tpl
XXCombChem10310515113D                 0.00000

 16 18999 V2000
   -0.8800    0.3800    0.5400 C   0  0  3
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   -6.7800   -1.7600    0.4400 C   0  0  0
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 14 16  1
  8  9  1
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M  END
$$$$
tpls\mol-109.tpl
XXCombChem10310515113D                 0.00000

 18 20999 V2000
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
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   -5.8000   -2.8400    0.1400 C   0  0  0
   -3.5000   -2.8200    0.0000 F   0  0  0
   -7.0400   -0.8400    0.6600 C   0  0  0
   -7.0200   -2.2200    0.3600 C   0  0  0
  1  2  1
  1  3  1
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 15 18  1
  8  9  1
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 17 18  2
M  END
$$$$
tpls\mol-11.tpl
XXCombChem10310515113D                 0.00000

 23 27999 V2000
   -0.7600    0.5600    0.6600 C   0  0  0
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    0.5400    4.7200    1.4000 C   0  0  0
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  5  9  2
 11 12  2
 14 19  1
 16 21  1
 22 23  1
M  END
$$$$
tpls\mol-110.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
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    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
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   -4.9800   -0.9200    2.2600 C   0  0  0
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 16 19  1
 19 20  1
  7  9  1
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 17 18  2
M  END
$$$$
tpls\mol-111.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -1.1800    3.7600    2.5800 C   0  0  3
   -0.7000    5.0200    1.7800 C   0  0  0
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    0.7800    4.8200    1.3200 C   0  0  0
   -0.7200    6.2600    2.7400 C   0  0  0
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    1.6600   -1.0000    0.9400 C   0  0  0
    1.7800    1.2200   -0.1600 C   0  0  0
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 16 19  1
 19 20  1
 19 21  1
  7  9  1
  7 10  1
 17 18  2
M  END
$$$$
tpls\mol-112.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
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   -6.6600   -2.8400   -0.9400 C   0  0  0
   -4.6200   -2.4800   -4.7800 C   0  0  0
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 16 19  1
 19 20  1
 20 21  2
  7  9  1
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 17 18  2
M  END
$$$$
tpls\mol-113.tpl
XXCombChem10310515113D                 0.00000

 19 21999 V2000
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
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   -6.0600   -2.6800    2.3200 C   0  0  0
   -4.6000   -1.4400    3.8000 C   0  0  0
   -5.5400   -3.2200    0.0200 C   0  0  0
   -3.5800   -2.4000   -1.1600 C   0  0  0
   -6.4000   -3.3200    1.1200 C   0  0  0
  1  2  1
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 14 18  1
 15 19  1
  8  9  1
  8 10  1
 17 19  2
M  END
$$$$
tpls\mol-115.tpl
XXCombChem10310515113D                 0.00000

 21 23  0  0  1  0999 V2000
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  1 21  1
M  END
$$$$
tpls\mol-116.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
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M  END
$$$$
tpls\mol-117.tpl
XXCombChem10310515113D                 0.00000

 19 21999 V2000
   -0.8800    0.3800   -0.5400 C   0  0  3
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M  END
$$$$
tpls\mol-118.tpl
XXCombChem10310515113D                 0.00000

 21 24999 V2000
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 20 21  1
M  END
$$$$
tpls\mol-119.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
   -6.7400   -1.6600   -0.4800 C   0  0  0
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   -9.1600   -1.8800   -0.6200 C   0  0  0
   -7.7600   -3.8200   -0.1000 C   0  0  0
   -3.3800    0.0600   -0.6200 C   0  0  0
   -8.8400    1.1600   -1.2400 C   0  0  0
   -9.0400   -3.2600   -0.3200 C   0  0  0
   -2.1000   -0.3800   -0.4400 N   0  0  0
   -3.5600    1.2200   -0.8800 O   0  0  0
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
    0.8200   -1.4800   -0.0400 C   0  0  0
    1.5200    0.5600   -1.3400 C   0  0  0
    1.0000    0.7600    1.1400 N   0  0  0
    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  7 11  1
  8 12  1
 10 13  1
 10 14  2
 13 15  1
 15 16  1
 15 17  1
 16 18  1
 16 19  1
 17 20  1
 18 21  1
 19 22  1
  5  7  1
  9 12  2
 20 21  1
 20 22  1
M  END
$$$$
tpls\mol-12.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.1800   -0.1800   -0.2600 C   0  0  0
    1.3800   -0.8600   -0.4800 C   0  0  0
    0.5400    1.1400    0.0800 C   0  0  0
   -1.1400   -0.5800   -0.3400 C   0  0  0
    2.4200    0.0400   -0.2400 C   0  0  0
    1.6600   -2.1800   -0.8800 C   0  0  0
    1.8800    1.2400    0.1200 N   0  0  0
   -0.4600    2.1800    0.3800 C   0  0  0
   -2.2400    0.3000    0.0400 C   0  0  3
   -1.4200   -1.7200   -0.7000 O   0  0  0
    3.7600   -0.3600   -0.3600 C   0  0  0
    3.0000   -2.6000   -1.0000 C   0  0  0
    2.6200    2.4000    0.4600 C   0  0  0
   -1.8600    1.8000   -0.2200 C   0  0  0
   -2.6800    0.0000    1.5200 C   0  0  0
    4.0400   -1.7000   -0.7600 C   0  0  0
   -4.1200   -0.4200    1.6400 C   0  0  0
    5.2800   -2.0800   -0.8800 F   0  0  0
   -4.6200   -1.6000    2.1600 C   0  0  0
   -5.1400    0.3600    1.2600 N   0  0  0
   -5.9600   -1.5000    2.0600 N   0  0  0
   -3.8800   -2.7400    2.6800 C   0  0  0
   -6.2600   -0.3200    1.5200 C   0  0  0
   -6.6000   -2.1800    2.3400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 11 16  1
 15 17  1
 16 18  1
 17 19  2
 17 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  1
  9 14  1
 12 16  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-120.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
   -2.1000   -0.3800   -0.4400 N   0  0  0
    0.8200   -1.4800   -0.0400 C   0  0  0
    1.5200    0.5600   -1.3400 C   0  0  0
    1.0000    0.7600    1.1400 N   0  0  0
   -3.0400   -0.5800   -1.4200 C   0  0  0
    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
   -4.2400   -1.3400   -1.3000 C   0  0  0
   -2.8000   -0.0400   -2.4800 O   0  0  0
   -4.9400   -1.4800   -0.0600 C   0  0  0
   -4.8000   -2.0000   -2.4200 C   0  0  0
   -6.1400   -2.2400    0.0800 C   0  0  0
   -5.9800   -2.7600   -2.3200 C   0  0  0
   -6.6400   -2.8600   -1.0800 C   0  0  0
   -6.8000   -2.3400    1.4200 C   0  0  0
   -6.9400   -3.6000    1.9200 F   0  0  0
   -6.0800   -1.6200    2.3400 F   0  0  0
   -8.0600   -1.8000    1.3400 F   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  4  8  1
  5  9  1
  6 10  1
  8 11  1
  8 12  2
 11 13  1
 11 14  2
 13 15  2
 14 16  1
 15 17  1
 15 18  1
 18 19  1
 18 20  1
 18 21  1
  7  9  1
  7 10  1
 16 17  2
M  END
$$$$
tpls\mol-121.tpl
XXCombChem10310515113D                 0.00000

 19 21999 V2000
   -0.8600   -0.4600    0.3000 C   0  0  3
    0.4200   -1.1200   -0.3400 C   0  0  0
   -0.5000    1.0400    0.6200 C   0  0  0
   -2.0600   -0.6200   -0.5000 N   0  0  0
    1.5800   -1.0600    0.7200 C   0  0  0
    0.8800   -0.2800   -1.5800 C   0  0  0
    0.9400    1.3600    0.3400 N   0  0  0
   -2.9200   -1.6600   -0.5000 C   0  0  0
    1.8200    0.4400    1.1200 C   0  0  0
    1.2000    1.1800   -1.1400 C   0  0  0
   -4.1000   -1.7800   -1.2800 C   0  0  0
   -2.6400   -2.5600    0.2800 O   0  0  0
   -4.2000   -1.2000   -2.5800 C   0  0  0
   -5.2200   -2.5200   -0.8400 C   0  0  0
   -5.3600   -1.3200   -3.3600 C   0  0  0
   -6.4000   -2.6600   -1.6200 C   0  0  0
   -6.4800   -2.0600   -2.8800 C   0  0  0
   -7.5600   -2.2200   -3.5200 O   0  0  0
   -8.2600   -1.5200   -4.4200 C   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  4  8  1
  5  9  1
  6 10  1
  8 11  1
  8 12  2
 11 13  1
 11 14  2
 13 15  2
 14 16  1
 15 17  1
 17 18  1
 18 19  1
  7  9  1
  7 10  1
 16 17  2
M  END
$$$$
tpls\mol-122.tpl
XXCombChem10310515113D                 0.00000

 16 18999 V2000
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
   -2.1000   -0.3800    0.4400 N   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
   -3.3800    0.0600    0.6200 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
   -4.5200   -0.7800    0.5200 C   0  0  0
   -3.5200    1.2400    0.8800 O   0  0  0
   -4.5800   -2.1200    0.2200 C   0  0  0
   -5.7800   -0.3200    0.7000 O   0  0  0
   -5.9000   -2.5000    0.2200 C   0  0  0
   -6.6400   -1.3600    0.5200 C   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  4  8  1
  5  9  1
  6 10  1
  7 11  1
  7 12  2
 11 13  2
 11 14  1
 13 15  1
 14 16  1
  8  9  1
  8 10  1
 15 16  2
M  END
$$$$
tpls\mol-123.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.4800   -0.2400   -0.1800 C   0  0  0
    0.6000   -1.0000    0.3000 C   0  0  0
   -0.1400    1.0400   -0.2800 N   0  0  0
   -1.7200   -0.7800   -0.5000 C   0  0  0
    1.6600   -0.1000    0.4800 C   0  0  0
    0.4200   -2.3800    0.4600 C   0  0  0
    1.1400    1.1600    0.1200 C   0  0  0
   -1.0400    2.0600   -0.7400 C   0  0  0
   -1.9000   -2.1800   -0.3400 C   0  0  0
   -2.7800    0.1400   -1.0200 C   0  0  0
    2.9600   -0.3200    0.9400 C   0  0  0
   -0.8200   -2.9800    0.1400 C   0  0  0
   -2.5400    1.6200   -0.6000 C   0  0  0
    3.5600   -1.6200    1.3600 C   0  0  0
    3.7600    0.6200    1.0400 O   0  0  0
    3.3200   -1.9200    2.8600 C   0  0  0
    1.8600   -1.9400    3.2200 C   0  0  0
    1.1400   -2.9800    3.8000 C   0  0  0
    1.0400   -0.9000    3.0200 N   0  0  0
   -0.1200   -2.5200    3.9400 N   0  0  0
    1.6200   -4.3000    4.2200 C   0  0  0
   -0.1600   -1.2800    3.4800 C   0  0  0
   -0.8600   -3.0200    4.3200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  8 13  1
 11 14  1
 11 15  2
 14 16  1
 16 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  2
  9 12  2
 10 13  1
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-124.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.2600   -0.0800    0.2000 C   0  0  0
   -1.5800    0.4600    0.4800 C   0  0  0
   -0.1000   -1.5000    0.2400 C   0  0  0
    0.8800    0.7000   -0.1200 C   0  0  0
   -2.6400   -0.4200    0.8800 C   0  0  0
   -1.9200    1.8400    0.3600 C   0  0  0
   -1.1800   -2.3400    0.5800 C   0  0  0
    1.2000   -2.1800   -0.0400 C   0  0  0
    2.0600    0.1000   -0.8000 C   0  0  3
    0.9600    1.8800    0.1800 O   0  0  0
   -2.4200   -1.8000    0.9200 C   0  0  0
   -3.9200    0.0800    1.2000 C   0  0  0
   -3.2000    2.3400    0.7000 C   0  0  0
    2.4200   -1.2000   -0.0600 C   0  0  0
    3.3200    1.0200   -0.9600 C   0  0  0
   -4.2000    1.4600    1.1200 C   0  0  0
    3.8800    1.5000    0.3400 C   0  0  0
    5.1400    1.3000    0.8600 C   0  0  0
    3.1800    2.2400    1.2200 N   0  0  0
    5.1800    1.9200    2.0600 N   0  0  0
    6.2600    0.5400    0.2800 C   0  0  0
    3.9800    2.4800    2.2600 C   0  0  0
    5.9400    1.9600    2.6600 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  1
  9 15  1
 12 16  1
 15 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  7 11  2
  9 14  1
 13 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-125.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.1600   -0.0600    0.1600 C   0  0  0
   -1.5200    0.3600    0.2600 C   0  0  0
    0.1200   -1.4800    0.1200 C   0  0  0
    0.9800    0.7800    0.0800 C   0  0  0
   -2.5800   -0.6200    0.1400 C   0  0  0
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   -0.9200   -2.4000    0.0400 C   0  0  0
    1.5200   -1.9800    0.0800 C   0  0  0
    2.2600    0.3600    0.2600 N   0  0  0
    0.8200    1.9600   -0.2200 O   0  0  0
   -2.2600   -1.9800    0.0400 C   0  0  0
   -3.9400   -0.2400    0.1800 C   0  0  0
   -3.3000    2.0800    0.4800 C   0  0  0
    2.4800   -1.0000    0.7400 C   0  0  0
    3.4200    1.2200    0.0400 C   0  0  0
   -4.3000    1.1000    0.3400 C   0  0  0
    3.5000    1.6600   -1.3800 C   0  0  0
    4.5200    1.4400   -2.3000 C   0  0  0
    2.5400    2.3800   -1.9800 N   0  0  0
    4.1400    2.0400   -3.4400 N   0  0  0
    5.7600    0.7000   -2.1000 C   0  0  0
    2.9400    2.6000   -3.2400 C   0  0  0
    4.6400    2.0400   -4.2800 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  1
  9 15  1
 12 16  1
 15 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  7 11  2
  9 14  1
 13 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-126.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    7.2050    6.9280   10.9590 C   0  0  0
    6.8850    7.0990    9.6320 N   0  0  0
    6.9800    5.5950   11.3460 C   0  0  0
    7.7130    7.8120   11.9430 C   0  0  0
    6.2250    5.8950    9.1780 C   0  0  3
    7.1070    8.1930    8.8500 C   0  0  0
    6.5350    4.7790   10.2160 C   0  0  3
    7.2240    5.1410   12.6590 C   0  0  0
    7.9610    7.3810   13.2600 C   0  0  0
    4.6960    6.1030    8.9750 C   0  0  0
    6.8380    8.3290    7.5330 N   0  0  0
    7.6320    9.1790    9.3500 O   0  0  0
    7.5870    3.7240    9.7860 C   0  0  0
    7.7130    6.0440   13.6180 C   0  0  0
    7.0810    9.4470    6.6460 C   0  0  1
    8.6060    9.6720    6.3810 C   0  0  0
    6.2850    9.4090    5.2970 C   0  0  0
    9.1430    8.9540    5.1040 C   0  0  2
    7.0460    8.7330    4.1130 C   0  0  1
    8.3730    9.3590    3.9050 N   0  0  0
    8.8980    7.4270    5.0410 C   0  0  0
    7.5290    7.2810    4.3350 C   0  0  0
    8.5100   10.7070    3.3080 C   0  0  0
    6.6910   10.3190    7.1840 H   0  0  0
   10.2090    9.1690    4.9840 H   0  0  0
    6.4310    8.7850    3.2090 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  6 11  1
  6 12  2
  7 13  1
  8 14  1
 15 11  1
 15 16  1
 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 14  2
 19 20  1
 21 22  1
 15 24  1
 18 25  1
 19 26  1
M  END
$$$$
tpls\mol-127.tpl
XXCombChem10310515113D                 0.00000

 25 29999 V2000
    0.9800   -0.4400   -0.3800 C   0  0  0
    0.4200    0.8000   -0.7000 C   0  0  0
    2.3800   -0.6800   -0.3200 C   0  0  0
    0.0600   -1.2800   -0.1800 O   0  0  0
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    1.2600    1.8800   -1.0200 C   0  0  0
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    3.2000    0.4600   -0.6200 C   0  0  0
   -1.1800   -0.8400   -0.3000 C   0  0  3
   -1.7200    1.6200    0.4000 C   0  0  0
    2.6400    1.7200   -0.9800 C   0  0  0
    0.7400    3.0800   -1.3800 N   0  0  0
    2.3000   -3.0800    0.3200 N   0  0  0
    4.2000   -2.0200    0.0400 O   0  0  0
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   -3.1600    1.1800    0.7000 C   0  0  0
    2.8800   -4.3600    0.6600 C   0  0  3
   -3.3400   -0.3400    1.0000 C   0  0  0
    2.0400   -5.5800    0.1600 C   0  0  0
    3.1200   -4.5400    2.2200 C   0  0  0
    0.7200   -5.7000    1.0200 C   0  0  0
    2.8800   -6.8800    0.4200 C   0  0  0
    2.6000   -5.8400    2.7200 N   0  0  0
    1.1000   -5.8800    2.5200 C   0  0  0
    3.2200   -6.9800    1.9400 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  6 12  1
  7 13  1
  7 14  2
  9 15  1
 10 16  1
 13 17  1
 15 18  1
 17 19  1
 17 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
  5  9  1
  8 11  2
 16 18  1
 23 24  1
 23 25  1
M  END
$$$$
tpls\mol-128.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    0.3000    0.0600   -0.1000 C   0  0  0
    1.6400   -0.3400   -0.0200 C   0  0  0
    0.3000    1.4200    0.1600 C   0  0  0
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    3.7000   -1.6400   -0.0400 C   0  0  0
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   -4.6600   -0.5200   -4.0000 C   0  0  0
   -3.2400   -1.4200   -5.2000 H   0  0  0
  1  2  1
  1  3  2
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  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  8 13  1
  9 14  1
 11 15  1
 14 16  1
 16 17  2
 16 18  1
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 18 21  2
  5  7  1
  9 13  1
 12 15  2
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-129.tpl
XXCombChem10310515113D                 0.00000

 25 29999 V2000
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    7.9800   -2.3400    0.7000 H   0  0  0
  1  2  1
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 21 24  2
  5  7  2
  9 12  2
 10 14  1
 15 17  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-13.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.3000   -0.0200    0.1400 C   0  0  0
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    5.8600   -1.1400    0.1000 C   0  0  0
    5.7000    2.1400    1.5800 C   0  0  0
   -1.6400   -1.9400   -2.0200 H   0  0  0
    7.3000    0.8200    1.5200 H   0  0  0
  1  2  1
  1  3  2
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 11 15  1
 14 16  1
 16 17  2
 16 18  1
 17 19  1
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  5  7  1
  9 13  1
 12 15  2
 19 21  1
  7 22  1
 19 23  1
M  END
$$$$
tpls\mol-130.tpl
XXCombChem10310515113D                 0.00000

 19 21999 V2000
    1.7400    0.2400    0.4600 C   0  0  0
    0.3600    0.1000    0.1000 C   0  0  0
    2.4400    1.3600    0.2800 N   0  0  0
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   -0.1800    0.8400   -0.9800 C   0  0  0
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    4.1800   -0.2200    1.3400 S   0  0  0
   -1.8600   -0.8800    0.4800 C   0  0  0
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   -2.3800   -0.1400   -0.6000 C   0  0  0
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    5.8400    3.3200   -2.7400 C   0  0  0
    4.1600    3.9600   -3.7400 H   0  0  0
  1  2  1
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 11 13  1
 13 14  2
 13 15  1
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 14 17  1
 15 18  2
  7  8  1
 10 12  2
 16 18  1
 16 19  1
M  END
$$$$
tpls\mol-131.tpl
XXCombChem10310515113D                 0.00000

 26 30999 V2000
   -4.5800   -2.1200   -0.2200 C   0  0  0
   -5.7400   -2.8600   -0.1400 C   0  0  0
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   -7.0000   -2.2600   -0.3400 C   0  0  0
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   -5.8200   -5.2800   -0.9600 C   0  0  0
   -7.0600   -0.8800   -0.6400 C   0  0  0
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   -0.8800    0.3800   -0.5400 C   0  0  3
   -3.5200   -6.5000   -0.6000 C   0  0  0
    0.3400   -0.4400   -1.1000 C   0  0  0
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    1.2200   -0.7200    1.2800 C   0  0  0
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  1  2  1
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 13 18  1
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  5  9  1
  8 11  2
 16 19  1
 24 25  1
 24 26  1
M  END
$$$$
tpls\mol-132.tpl
XXCombChem10310515113D                 0.00000

 25 28  0  0  1  0999 V2000
   -2.2680   -0.5900    1.3150 C   0  0  0
   -2.3160   -0.5700   -0.0560 N   0  0  0
   -3.3510   -1.3260    1.8250 C   0  0  0
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   -3.5660   -1.5130    3.2050 C   0  0  0
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    0.8060    1.0450   -1.4930 C   0  0  1
    1.4410    2.2430   -0.7110 C   0  0  0
    1.8770    0.0920   -2.1180 C   0  0  0
    2.8370    1.9440   -0.0800 C   0  0  2
    3.2240    0.0210   -1.3350 C   0  0  1
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    4.3320    2.2020   -2.1720 C   0  0  0
    0.2750    1.4990   -2.3370 H   0  0  0
    3.2360    2.8630    0.3620 H   0  0  0
    3.9340   -0.5960   -1.8940 H   0  0  0
  1  2  1
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 18 21  1
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  5  7  1
  9 13  2
 18 19  1
 20 21  1
 14 23  1
 17 24  1
 18 25  1
M  END
$$$$
tpls\mol-133.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
   -2.9560    0.5400   -0.7850 C   0  0  0
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   -3.7880   -0.5380   -0.4270 C   0  0  0
   -3.5640    1.6910   -1.3440 C   0  0  0
   -1.5820   -1.1680   -0.2080 C   0  0  3
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   -0.7680    2.2840   -0.7090 O   0  0  0
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    1.8940    1.6100   -0.1220 C   0  0  1
    2.4910    1.7050    1.3210 C   0  0  0
    2.9480    1.1540   -1.1840 C   0  0  0
    3.6680    0.7220    1.6090 C   0  0  2
    4.0770    0.2290   -0.6310 C   0  0  1
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    3.3530   -0.7860    1.4760 C   0  0  0
    3.6250   -1.1130   -0.0110 C   0  0  0
    5.6020    2.0050    0.4680 C   0  0  0
    1.6240    2.6350   -0.3980 H   0  0  0
    4.0740    0.9260    2.6050 H   0  0  0
    4.8090    0.0400   -1.4230 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
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 16 11  1
 16 17  1
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  9 15  2
 20 21  1
 22 23  1
 16 25  1
 19 26  1
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M  END
$$$$
tpls\mol-134.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
    6.8910    6.2940    5.5590 C   0  0  0
    7.2570    7.1970    4.5440 C   0  0  0
    6.5520    6.9680    6.7040 N   0  0  0
    6.9130    4.9120    5.2500 C   0  0  0
    7.2150    8.5910    5.0010 C   0  0  3
    7.6060    6.7570    3.2490 C   0  0  0
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    5.7660    8.6430   12.1200 C   0  0  1
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    4.6480    6.0000   10.1490 H   0  0  0
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  1  2  1
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 20 21  1
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 16 25  1
 19 26  1
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M  END
$$$$
tpls\mol-135.tpl
XXCombChem10310515113D                 0.00000

 28 32  0  0  1  0999 V2000
   -1.5670   -0.8000   -0.7410 C   0  0  0
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    5.9000    1.3750    1.0090 C   0  0  0
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  1  2  1
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 23 24  1
 16 26  1
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M  END
$$$$
tpls\mol-136.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    0.3200    0.2000    0.0200 C   0  0  0
    1.6000   -0.1800    0.4000 C   0  0  0
    0.1000    1.5400    0.3000 C   0  0  0
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   -3.3000   -3.7000    0.6000 C   0  0  0
   -5.3000   -3.7000    1.1200 H   0  0  0
  1  2  1
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  5  7  1
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 12 15  2
 19 21  1
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M  END
$$$$
tpls\mol-137.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
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   -5.5000    2.5400    1.2400 N   0  0  0
   -6.6400    3.1800   -0.5400 N   0  0  0
    0.8400    2.9600   -0.3600 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
 10 14  1
 12 15  1
 15 16  1
 16 17  1
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 17 19  2  3  0  0  0
  5  9  1
 11 14  2
 12 13  1
  9 20  1
M  END
$$$$
tpls\mol-138.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.7800   -0.4600    1.2800 C   0  0  0
   -4.5800   -0.7200    0.5200 C   0  0  0
   -6.9200   -1.3000    1.1600 C   0  0  0
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   -7.9800    1.5400    2.1600 C   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
   -5.7200   -3.9800   -1.5600 Cl  0  0  0
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   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
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  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
 13 14  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-139.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.7800   -0.4600    1.2800 C   0  0  0
   -4.5800   -0.7200    0.5200 C   0  0  0
   -6.9200   -1.3000    1.1600 C   0  0  0
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   -7.9800    1.5400    2.1400 C   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
   -5.7200   -4.1000   -1.6600 Br  0  0  0
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
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  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
 13 14  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-14.tpl
XXCombChem10310515113D                 0.00000

 28 32999 V2000
    0.3800   -0.8000   -0.2000 C   0  0  0
   -0.1200    0.5000   -0.1000 C   0  0  0
   -0.7400   -1.6400   -0.3000 C   0  0  0
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    2.1200   -2.2600   -0.3000 O   0  0  0
   -2.3600    1.6000    0.0400 C   0  0  0
    2.2200    1.3400   -0.5000 C   0  0  0
   -3.1600   -1.3800   -0.3000 C   0  0  0
   -2.1600   -3.6000   -0.5000 C   0  0  0
    3.1800   -0.0200    1.5400 C   0  0  0
   -1.9800    2.6000    1.1800 C   0  0  0
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   -1.7400    4.0400    0.6600 C   0  0  0
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    5.2400   -1.2400    2.5000 C   0  0  0
   -3.9800    3.9400    1.7200 C   0  0  0
   -3.1200    4.7200    0.7000 C   0  0  0
    6.7600    0.0400    1.6200 C   0  0  0
    6.5600   -1.0400    2.3800 N   0  0  0
    4.6000   -2.3400    3.2200 C   0  0  0
    7.2600   -1.5800    2.8000 H   0  0  0
  1  2  2
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  4 10  2
  5 11  1
  6 12  1
  7 13  2
  8 14  1
  9 15  1
 11 16  1
 13 17  1
 15 18  1
 16 19  1
 16 20  1
 18 21  1
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 19 23  1
 20 24  1
 21 25  2
 22 26  1
 22 27  1
  5  7  1
  9 12  1
 14 17  2
 23 24  1
 25 26  1
 26 28  1
M  END
$$$$
tpls\mol-140.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.7800   -0.4600    1.2600 C   0  0  0
   -4.5800   -0.7200    0.5200 C   0  0  0
   -6.9200   -1.3200    1.1800 C   0  0  0
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   -7.9600    1.5600    2.0800 C   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 10 16  1
 16 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
 14 15  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-141.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.6800   -1.6400   -0.4600 C   0  0  0
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   -7.9600   -0.9800   -4.8400 C   0  0  0
   -0.8600   -0.4600    0.3000 C   0  0  3
    0.4200   -1.1200   -0.3400 C   0  0  0
   -0.5000    1.0400    0.6200 C   0  0  0
    1.5800   -1.0600    0.7200 C   0  0  0
    0.8800   -0.2800   -1.5800 C   0  0  0
    0.9400    1.3600    0.3400 N   0  0  0
    1.8200    0.4400    1.1200 C   0  0  0
    1.2000    1.1800   -1.1400 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  7 14  2
  9 15  1
 11 16  1
 13 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  8 10  2
 12 15  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-142.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.7800   -0.4600    1.2600 C   0  0  0
   -6.9800   -1.2200    1.0600 C   0  0  0
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    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
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    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  7 14  2
  9 15  1
 10 16  1
 13 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  8 10  2
 12 15  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-143.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.7800   -0.4600    1.2600 C   0  0  0
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    0.3400   -0.4400    1.1000 C   0  0  0
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  1  2  1
  1  3  2
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  3  8  1
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 17 19  1
 18 20  1
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 20 23  1
 21 24  1
  8 10  2
 12 15  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-144.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
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  1  2  1
  1  3  2
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 17 18  1
 17 19  1
 18 20  1
 18 21  1
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 20 23  1
 21 24  1
  7 12  2
 13 14  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-145.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
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    1.2000    1.1800   -1.1400 C   0  0  0
  1  2  1
  1  3  2
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 17 20  1
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 21 24  1
 22 25  1
  7 12  2
 13 14  1
 23 24  1
 23 25  1
M  END
$$$$
tpls\mol-146.tpl
XXCombChem10310515113D                 0.00000

 23 25999 V2000
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   -2.9000   -1.9800    0.9200 F   0  0  0
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    3.1600    2.7800   -1.7400 C   0  0  0
    2.5400   -0.3600   -3.1200 C   0  0  0
    1.8800   -1.5600   -3.3000 C   0  0  0
    3.8600   -0.5800   -3.2200 N   0  0  0
    2.8200   -2.5000   -3.5000 N   0  0  0
    0.4400   -1.8000   -3.3000 C   0  0  0
    4.0200   -1.9000   -3.4600 C   0  0  0
    2.6800   -3.4400   -3.6600 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
  8 14  1
 10 15  1
 10 16  1
 15 17  1
 17 18  2
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 18 20  1
 18 21  1
 19 22  2
  5  7  1
  9 13  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-147.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.2800    0.2600    0.0400 C   0  0  0
    1.5600   -0.1600    0.4000 C   0  0  0
    0.2400    0.1800   -1.3600 C   0  0  0
   -0.8200    0.6600    0.8000 C   0  0  0
    2.2400   -0.5000   -0.7800 C   0  0  0
    2.1800   -0.2800    1.6600 C   0  0  0
    1.4200   -0.2800   -1.8200 N   0  0  0
   -0.9600    0.5800   -2.1400 C   0  0  0
   -2.1200    0.9600    0.1800 C   0  0  3
   -0.7200    0.7600    2.0200 O   0  0  0
    3.5800   -0.9600   -0.7000 C   0  0  0
    3.5000   -0.7400    1.7400 C   0  0  0
    1.7200   -0.5200   -3.2000 C   0  0  0
   -1.9200    1.4600   -1.3000 C   0  0  0
   -3.0600   -0.2800    0.2400 C   0  0  0
    4.2000   -1.0800    0.5600 C   0  0  0
    4.2400   -1.2800   -1.7800 F   0  0  0
   -4.3400   -0.0400    0.9600 C   0  0  0
   -4.6200   -0.2200    2.3200 C   0  0  0
   -5.4400    0.4400    0.3600 N   0  0  0
   -5.9000    0.1600    2.5000 N   0  0  0
   -3.7000   -0.6800    3.3600 C   0  0  0
   -6.3800    0.5400    1.3200 C   0  0  0
   -6.3800    0.1400    3.3400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 11 16  1
 11 17  1
 15 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  1
  9 14  1
 12 16  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-148.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.2600   -0.0400   -0.2000 C   0  0  0
    1.4600    0.6400   -0.4000 C   0  0  0
    0.4200   -0.7600    0.9800 C   0  0  0
   -0.9200   -0.0600   -0.9400 C   0  0  0
    2.3000    0.3000    0.6600 C   0  0  0
    1.9200    1.5000   -1.4200 C   0  0  0
    1.6400   -0.5400    1.4800 N   0  0  0
   -0.6400   -1.6400    1.5400 C   0  0  0
   -2.1000   -0.8000   -0.4400 C   0  0  3
   -1.0000    0.5400   -2.0000 O   0  0  0
    3.6000    0.8400    0.7600 C   0  0  0
    3.2200    2.0400   -1.3400 C   0  0  0
   -1.6800   -2.0200    0.4600 C   0  0  0
   -3.1000    0.1600    0.3000 C   0  0  0
    4.0600    1.7000   -0.2600 C   0  0  0
    4.3800    0.5200    1.7600 F   0  0  0
   -4.4600    0.1800   -0.3200 C   0  0  0
   -4.9400    1.0400   -1.3000 C   0  0  0
   -5.4400   -0.6600    0.0400 N   0  0  0
   -6.2200    0.7000   -1.5200 N   0  0  0
   -4.2200    2.1200   -2.0000 C   0  0  0
   -6.5200   -0.3400   -0.7200 C   0  0  0
    2.0000   -0.9200    2.3000 H   0  0  0
   -6.8400    1.1000   -2.1600 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  8 13  1
  9 14  1
 11 15  1
 11 16  1
 14 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  1
  9 13  1
 12 15  2
 20 22  1
  7 23  1
 20 24  1
M  END
$$$$
tpls\mol-149.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.2200   -0.1000   -0.2200 C   0  0  0
    1.4600   -0.6600    0.0600 C   0  0  0
    0.4600    1.0200   -1.0000 C   0  0  0
   -1.0800   -0.4800    0.1200 C   0  0  0
    2.4400    0.1400   -0.5600 C   0  0  0
    1.8200   -1.8000    0.8000 C   0  0  0
    1.8000    1.1600   -1.1800 N   0  0  0
   -0.6200    1.9000   -1.5000 C   0  0  0
   -2.1800    0.2200   -0.2800 N   0  0  0
   -1.2200   -1.4800    0.8200 O   0  0  0
    3.8200   -0.2000   -0.4200 C   0  0  0
    3.1800   -2.1400    0.9200 C   0  0  0
    2.3800    2.2200   -1.9200 C   0  0  0
   -2.0600    1.4000   -1.1200 C   0  0  0
   -3.5200   -0.1800    0.1000 C   0  0  0
    4.1600   -1.3600    0.3200 C   0  0  0
    4.9000    0.6000   -1.0400 C   0  0  0
   -4.1200   -1.1400   -0.8800 C   0  0  0
   -3.6600   -2.3800   -1.2600 C   0  0  0
   -5.2400   -0.8800   -1.5400 N   0  0  0
   -4.5200   -2.8600   -2.1600 N   0  0  0
   -2.4600   -3.0800   -0.7800 C   0  0  0
   -5.4800   -1.9400   -2.3200 C   0  0  0
   -4.4800   -3.7200   -2.6000 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
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  8 14  1
  9 15  1
 11 16  1
 11 17  1
 15 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  1
  9 14  1
 12 16  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-15.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
    0.2400    0.5400    0.3000 C   0  0  0
   -0.4200   -0.7000    0.3000 C   0  0  0
   -0.7200    1.4800   -0.1200 C   0  0  0
    1.5800    0.7000    0.6400 C   0  0  0
   -1.7000   -0.5600   -0.1200 N   0  0  0
    0.2800   -1.9400    0.7400 C   0  0  0
   -1.9000    0.7600   -0.3600 C   0  0  0
   -0.6800    2.8800   -0.3000 C   0  0  0
    2.4200   -0.4600    0.9200 C   0  0  3
    2.0800    1.8200    0.6800 O   0  0  0
   -2.6600   -1.6200   -0.3000 C   0  0  0
    1.5800   -1.6200    1.5400 C   0  0  0
   -3.0600    1.4400   -0.8000 C   0  0  0
   -1.8400    3.5400   -0.7400 C   0  0  0
    3.2200   -0.9200   -0.3400 C   0  0  0
   -2.1600   -2.7000   -0.9400 C   0  0  0
   -3.0200    2.8400   -0.9800 C   0  0  0
    4.7000   -0.9000   -0.1800 C   0  0  0
   -1.7000   -3.6600   -1.5200 C   0  0  0
    5.4600   -1.5800    0.7600 C   0  0  0
    5.5200   -0.1800   -0.9400 N   0  0  0
    6.7400   -1.2400    0.5200 N   0  0  0
    5.0200   -2.5200    1.8000 C   0  0  0
    6.7600   -0.4000   -0.5200 C   0  0  0
    7.5200   -1.5600    1.0000 H   0  0  0
  1  2  2
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  4 10  2
  5 11  1
  6 12  1
  7 13  2
  8 14  1
  9 15  1
 11 16  1
 13 17  1
 15 18  1
 16 19  3
 18 20  2
 18 21  1
 20 22  1
 20 23  1
 21 24  2
  5  7  1
  9 12  1
 14 17  2
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-150.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.2000   -0.1200   -0.2400 C   0  0  0
    1.3800   -0.8400   -0.0600 C   0  0  0
    0.5800    1.1000   -0.8000 C   0  0  0
   -1.1400   -0.4000    0.0400 C   0  0  0
    2.4400   -0.0600   -0.5200 C   0  0  0
    1.6000   -2.1400    0.4600 C   0  0  0
    1.9200    1.1200   -0.9600 N   0  0  0
   -0.3800    2.1600   -1.1400 C   0  0  0
   -2.1400    0.4800   -0.2400 N   0  0  0
   -1.3800   -1.5000    0.5400 O   0  0  0
    3.7600   -0.5400   -0.4600 C   0  0  0
    2.9200   -2.6200    0.5200 C   0  0  0
    2.6800    2.2000   -1.5000 C   0  0  0
   -1.8800    1.7600   -0.8600 C   0  0  0
   -3.5200    0.1600    0.0600 C   0  0  0
    4.0000   -1.8400    0.0600 C   0  0  0
    4.7800    0.1600   -0.8800 F   0  0  0
   -4.2000   -0.5400   -1.0800 C   0  0  0
   -3.8600   -1.7400   -1.6600 C   0  0  0
   -5.2800   -0.0400   -1.6800 N   0  0  0
   -4.7600   -1.9600   -2.6400 N   0  0  0
   -2.7600   -2.6400   -1.3200 C   0  0  0
   -5.6200   -0.9200   -2.6400 C   0  0  0
   -4.8000   -2.7200   -3.2400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 11 16  1
 11 17  1
 15 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  1
  9 14  1
 12 16  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-151.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
    0.2400    0.0200    0.0800 C   0  0  0
    1.6200   -0.1800   -0.0600 C   0  0  0
    0.0200    1.3800   -0.0400 C   0  0  0
   -0.8200   -0.8600    0.3000 C   0  0  0
    2.2000    1.1000   -0.2600 C   0  0  0
    2.4600   -1.3200   -0.0200 C   0  0  0
    1.2000    2.0200   -0.2400 N   0  0  0
   -1.3200    2.0000    0.0400 C   0  0  0
   -2.1000   -0.4400    0.4200 N   0  0  0
   -0.5800   -2.0600    0.3800 O   0  0  0
    3.5800    1.2400   -0.4400 C   0  0  0
    3.8400   -1.1800   -0.2000 C   0  0  0
    2.0000   -2.5200    0.1800 F   0  0  0
    1.3600    3.4200   -0.4200 C   0  0  0
   -2.4400    0.9800    0.3800 C   0  0  0
   -3.2000   -1.3600    0.6400 C   0  0  0
    4.4000    0.1000   -0.4000 C   0  0  0
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   -3.0200   -2.1600    1.9000 C   0  0  0
   -3.8600   -2.2200    3.0000 C   0  0  0
   -1.9600   -2.9600    2.1200 N   0  0  0
   -3.2800   -3.0600    3.8600 N   0  0  0
   -5.1400   -1.5400    3.2000 C   0  0  0
   -2.1400   -3.5000    3.3200 C   0  0  0
   -3.6400   -3.3200    4.7400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  6 13  1
  7 14  1
  8 15  1
  9 16  1
 11 17  1
 11 18  1
 16 19  1
 19 20  2
 19 21  1
 20 22  1
 20 23  1
 21 24  2
  5  7  1
  9 15  1
 12 17  2
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-152.tpl
XXCombChem10310515113D                 0.00000

 26 29999 V2000
   -0.1800    0.4200    0.1200 C   0  0  0
    0.9800    1.1800    0.2400 C   0  0  0
    0.2400   -0.8800   -0.1400 C   0  0  0
   -1.5200    0.7600    0.2200 C   0  0  0
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   -1.8000    1.9200    0.4400 O   0  0  0
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    2.4000   -2.1000   -0.4400 C   0  0  0
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    3.0200   -2.5800    0.7000 C   0  0  0
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    3.5600   -2.9800    1.6800 C   0  0  0
   -3.9600    0.8400    2.7200 C   0  0  0
   -5.4200   -0.6800    2.0200 N   0  0  0
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   -2.8800    1.8400    2.7800 C   0  0  0
   -5.5800   -0.4600    3.3400 C   0  0  0
   -4.6400    0.7600    4.6800 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
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  3  7  1
  3  8  1
  4  9  1
  4 10  2
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  6 12  1
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 11 16  1
 11 17  1
 13 18  1
 15 19  1
 18 20  3
 19 21  2
 19 22  1
 21 23  1
 21 24  1
 22 25  2
  5  7  1
  9 14  1
 12 16  2
 23 25  1
 23 26  1
M  END
$$$$
tpls\mol-153.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
    0.0200   -0.1400    0.1200 C   0  0  0
    1.3000   -0.4600    0.6000 C   0  0  0
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    2.0400    0.4800   -2.8200 C   0  0  0
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    4.0200   -0.9600    1.0600 C   0  0  0
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   -3.9000   -2.3800    1.0200 C   0  0  0
   -5.5200   -1.3200   -0.0600 N   0  0  0
   -4.8400   -3.2800    0.6800 N   0  0  0
   -2.6600   -2.6800    1.7600 C   0  0  0
   -5.8200   -2.6400    0.0400 C   0  0  0
    4.5000   -0.3400   -1.1600 C   0  0  0
    5.2800   -0.2000   -1.9800 N   0  0  0
   -4.8200   -4.2400    0.8600 H   0  0  0
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
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 11 16  1
 11 23  1
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 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  1
  9 14  1
 12 16  2
 20 22  1
  1  2  1
 23 24  3
 20 25  1
M  END
$$$$
tpls\mol-154.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    5.5380    3.2360    4.7560 C   0  0  0
    6.4830    4.0660    5.3750 C   0  0  0
    5.4190    3.6560    3.4210 C   0  0  0
    4.7540    2.1520    5.2060 C   0  0  0
    6.9520    4.0600    6.6790 C   0  0  0
    6.8910    4.9490    4.3690 C   0  0  0
    6.2490    4.6890    3.2210 N   0  0  0
    4.5400    3.0200    2.5240 C   0  0  0
    3.8700    1.5060    4.3190 C   0  0  0
    7.7810    4.9040    7.0550 O   0  0  0
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    3.7640    1.9390    2.9830 C   0  0  0
    8.4770    5.2590    8.1460 C   0  0  1
    9.4660    6.3980    7.7480 C   0  0  0
    7.5850    5.6950    9.3510 C   0  0  0
    8.8600    7.8320    7.8670 C   0  0  2
    7.1550    7.1940    9.3040 C   0  0  1
    8.3420    7.9960    9.1960 N   0  0  0
    7.5610    8.1070    7.0730 C   0  0  0
    6.4240    7.6600    8.0220 C   0  0  0
    8.8610    8.8140   10.1200 C   0  0  0
    8.3540    8.9710   11.3230 N   0  0  0
    6.3730    5.1730    2.3860 H   0  0  0
    9.0610    4.3770    8.4310 H   0  0  0
    9.6340    8.5530    7.5780 H   0  0  0
    6.5340    7.3990   10.1820 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
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  5 11  2
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 13 10  1
 13 14  1
 13 15  1
 14 16  1
 15 17  1
 16 18  1
 16 19  1
 17 20  1
 18 21  1
 21 22  2  3  0  0  0
  6  7  1
  9 12  2
 17 18  1
 19 20  1
  7 23  1
 13 24  1
 16 25  1
 17 26  1
M  END
$$$$
tpls\mol-155.tpl
XXCombChem10310515113D                 0.00000

 24 26  0  0  1  0999 V2000
   -1.8700   -1.4460   -0.5330 C   0  0  1
   -2.9380   -0.4910   -0.4330 N   0  0  0
   -0.9280   -1.0100   -1.7000 C   0  0  0
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   -2.1870   -2.4780   -0.7190 H   0  0  0
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   -0.1330    0.8070   -2.5830 H   0  0  0
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 18 19  2
  1 22  1
  5 23  1
  7 24  1
M  END
$$$$
tpls\mol-156.tpl
XXCombChem10310515113D                 0.00000

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    5.9970    6.8780    4.7770 H   0  0  0
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  1  2  1
  1  3  1
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  2  6  1
  3  7  1
  4  8  1
  5  9  1
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  7  9  1
 19 20  2
  1 23  1
  5 24  1
  7 25  1
M  END
$$$$
tpls\mol-157.tpl
XXCombChem10310515113D                 0.00000

 25 29999 V2000
   -1.5200    0.5600   -0.2400 C   0  0  0
   -0.4000    1.3400    0.0800 C   0  0  0
   -1.1600   -0.7000   -0.4600 N   0  0  0
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    4.3600   -0.1000    0.4600 C   0  0  0
    5.1000    0.3200   -0.7600 C   0  0  0
    4.8800    1.4200   -1.5600 C   0  0  0
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    3.8800    2.4800   -1.4000 C   0  0  0
    6.5400    0.2800   -2.3600 C   0  0  0
    5.9000    2.0200   -3.2800 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
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  6 12  1
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  8 14  1
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  5  7  2
  9 12  2
 10 14  1
 15 17  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-159.tpl
XXCombChem10310515113D                 0.00000

 25 29999 V2000
   -2.0800    0.1400   -0.3200 C   0  0  0
   -1.1000    1.1200   -0.3800 C   0  0  0
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    3.2000    2.5400    4.9200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
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  3  8  1
  4  9  1
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 11 14  1
 11 15  2
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  5  7  2
  8  9  1
 10 12  2
 16 18  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-16.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.4600    0.0000   -0.1200 C   0  0  0
    1.6800   -0.3200   -0.7600 C   0  0  0
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    2.1200   -1.4400   -1.4800 C   0  0  0
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   -1.8200   -0.5400    0.8400 C   0  0  3
   -0.7600   -1.7600   -0.8000 O   0  0  0
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   -5.6800   -0.3800    0.1400 C   0  0  0
   -4.2600   -2.7200   -2.1800 C   0  0  0
   -6.0200   -1.6600   -2.3200 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
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  5  7  1
 12 17  2
 14 16  1
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-160.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    5.4000   -0.7800   -1.7400 C   0  0  0
    4.0600   -0.4000   -1.5800 C   0  0  0
    5.7400   -0.5400   -3.0800 C   0  0  0
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   -1.8000   -0.3400    1.0600 C   0  0  0
    4.6400    0.2200   -4.6400 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
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 17 21  1
  6  7  1
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 18 20  1
 18 21  1
  7 22  1
M  END
$$$$
tpls\mol-161.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    5.4000   -0.7800   -1.7400 C   0  0  0
    4.0600   -0.4000   -1.5800 C   0  0  0
    5.7400   -0.5400   -3.0800 C   0  0  0
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   -1.2400   -0.6200   -1.3400 C   0  0  0
   -1.8000   -0.3400    1.0600 C   0  0  0
  1  2  1
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  3  8  2
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  8 13  1
 10 14  1
 14 15  1
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 16 20  2
 17 21  1
 18 22  1
  6  7  1
  9 13  2
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-162.tpl
XXCombChem10310515113D                 0.00000

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 16 25  1
 19 26  1
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M  END
$$$$
tpls\mol-163.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
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    1.8600    1.2800    0.0000 C   0  0  0
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 18 20  1
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 20 23  1
 21 24  1
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 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-164.tpl
XXCombChem10310515113D                 0.00000

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 14 10  1
 14 15  1
 14 16  1
 15 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 13  2
 18 19  1
 21 23  1
 14 24  1
 17 25  1
 18 26  1
M  END
$$$$
tpls\mol-165.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    0.2000    0.4200    0.1000 C   0  0  0
    1.3200    1.1800   -0.2400 C   0  0  0
    0.6800   -0.8400    0.4600 C   0  0  0
   -1.1600    0.7400    0.1000 C   0  0  0
    2.4400    0.3400   -0.0800 C   0  0  0
    1.4600    2.5200   -0.6400 C   0  0  0
    2.0200   -0.8800    0.3200 N   0  0  0
   -0.2400   -1.9400    0.9000 C   0  0  0
   -2.1800   -0.2800    0.3800 C   0  0  3
   -1.5400    1.8600   -0.1800 O   0  0  0
    3.7200    0.8400   -0.3600 C   0  0  0
    2.7600    3.0200   -0.9200 C   0  0  0
    2.8600   -2.0000    0.5800 C   0  0  0
   -1.6200   -1.3800    1.3600 C   0  0  0
   -2.7600   -0.8600   -0.9600 C   0  0  0
    3.8800    2.1800   -0.7600 C   0  0  0
   -3.8000   -1.8600   -0.7600 N   0  0  0
   -4.9600   -1.7200   -0.1200 C   0  0  0
   -3.7400   -3.1000   -1.2400 C   0  0  0
   -5.6600   -2.8800   -0.1800 N   0  0  0
   -5.5000   -0.5200    0.5400 C   0  0  0
   -4.9000   -3.7400   -0.8600 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 11 16  1
 15 17  1
 17 18  1
 17 19  1
 18 20  2
 18 21  1
 19 22  2
  5  7  1
  9 14  1
 12 16  2
 20 22  1
M  END
$$$$
tpls\mol-166.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    0.0600    0.2600   -0.3800 C   0  0  0
   -1.2200   -0.3400   -0.6000 C   0  0  0
    0.1000    1.5400    0.2600 C   0  0  0
    1.3400   -0.2800   -0.7000 C   0  0  0
   -2.4000    0.3400   -0.1600 C   0  0  0
   -1.4200   -1.6200   -1.2200 C   0  0  0
   -1.0600    2.1800    0.7200 C   0  0  0
    1.2000    2.1800    0.4200 O   0  0  0
    2.5800    0.3000   -0.1600 C   0  0  3
    1.4800   -1.2400   -1.4600 O   0  0  0
   -2.3000    1.5800    0.5000 C   0  0  0
   -3.6800   -0.2200   -0.3800 C   0  0  0
   -2.7000   -2.1600   -1.4200 C   0  0  0
    2.4000    1.8400   -0.0400 C   0  0  0
    2.9200   -0.3400    1.2400 C   0  0  0
   -3.8400   -1.4600   -1.0000 C   0  0  0
    1.8600   -0.1600    2.2800 C   0  0  0
    1.9800    0.4800    3.5000 C   0  0  0
    0.6200   -0.6000    2.1400 N   0  0  0
    0.7800    0.4000    4.0800 N   0  0  0
    3.1600    1.1200    4.0800 C   0  0  0
   -0.0600   -0.2400    3.2400 C   0  0  0
    0.5200    0.7600    4.9600 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  1
  9 15  1
 12 16  1
 15 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  7 11  2
  9 14  1
 13 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-167.tpl
XXCombChem10310515113D                 0.00000

 28 32  0  0  1  0999 V2000
   -5.8000   -1.0600   -0.3000 C   0  0  0
   -6.9400   -1.2000   -1.0800 C   0  0  0
   -4.5000   -0.9200   -0.8600 C   0  0  0
   -6.1200   -1.1000    0.9200 O   0  0  0
   -8.1200   -1.3400   -0.2400 C   0  0  1
   -6.8400   -1.2200   -2.4800 C   0  0  0
   -3.3200   -0.7600   -0.0600 C   0  0  0
   -4.4400   -0.9200   -2.2800 C   0  0  0
   -7.4400   -1.2400    1.1600 C   0  0  2
   -9.2000   -0.2400   -0.4800 C   0  0  0
   -5.5800   -1.0800   -3.0800 C   0  0  0
   -2.0600   -0.6200   -0.5000 N   0  0  0
   -3.4600   -0.7600    1.1600 O   0  0  0
   -7.9400   -0.1000    2.0600 C   0  0  0
   -8.7600    1.1800   -0.0800 C   0  0  0
   -5.4400   -1.0800   -4.7800 Cl  0  0  0
   -0.8600   -0.4600    0.3000 C   0  0  1
   -8.0200    1.2600    1.3000 C   0  0  0
    0.4200   -1.1200   -0.3400 C   0  0  0
   -0.5000    1.0400    0.6200 C   0  0  0
    1.5800   -1.0600    0.7200 C   0  0  0
    0.8800   -0.2800   -1.5800 C   0  0  0
    0.9400    1.3600    0.3400 N   0  0  0
    1.8200    0.4400    1.1200 C   0  0  0
    1.2000    1.1800   -1.1400 C   0  0  0
   -8.5600   -2.3200   -0.4000 H   0  0  0
   -7.5600   -2.2000    1.7000 H   0  0  0
   -1.0400   -0.9800    1.2400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  7 12  1
  7 13  2
  9 14  1
 10 15  1
 11 16  1
 17 12  1
 14 18  1
 17 19  1
 17 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
  5  9  1
  8 11  2
 15 18  1
 23 24  1
 23 25  1
  5 26  1
  9 27  1
 17 28  1
M  END
$$$$
tpls\mol-168.tpl
XXCombChem10310515113D                 0.00000

 28 31999 V2000
    4.2000    0.5800    4.2800 C   0  0  0
    3.8200    0.2400    2.9800 C   0  0  0
    5.5000    0.1200    4.4400 C   0  0  0
    3.5600    1.2400    5.3600 C   0  0  0
    2.6200    0.4600    2.2800 C   0  0  0
    4.8800   -0.3800    2.4400 N   0  0  0
    5.8600   -0.4400    3.2800 N   0  0  0
    6.2200    0.3000    5.6200 C   0  0  0
    4.2600    1.4200    6.5800 C   0  0  0
    2.4000    0.0600    1.0000 N   0  0  0
    1.7000    1.0400    2.8600 O   0  0  0
    5.6000    0.9400    6.7000 C   0  0  0
    1.2000    0.2400    0.2200 C   0  0  3
    0.0200   -0.5000    0.9200 C   0  0  0
    0.9400    1.7800    0.0600 C   0  0  0
   -1.1800   -0.8600    0.0800 N   0  0  0
   -0.1200    2.1400   -0.9400 N   0  0  0
   -2.3800   -1.2600    0.9000 C   0  0  0
   -1.5200    0.0600   -1.0600 C   0  0  0
   -1.4800    1.5800   -0.7400 C   0  0  0
   -0.1600    3.6200   -1.1200 C   0  0  0
   -2.0600   -2.2600    1.9400 C   0  0  0
   -2.7800   -2.3000    3.1600 C   0  0  0
   -1.0200   -3.2000    1.7600 C   0  0  0
   -2.4600   -3.2600    4.1400 C   0  0  0
   -0.7200   -4.1200    2.7200 N   0  0  0
   -1.4000   -4.1800    3.9000 C   0  0  0
    6.7200   -0.8600    3.0800 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  8 12  1
 10 13  1
 13 14  1
 13 15  1
 14 16  1
 15 17  1
 16 18  1
 16 19  1
 17 20  1
 17 21  1
 18 22  1
 22 23  1
 22 24  2
 23 25  2
 24 26  1
 25 27  1
  6  7  1
  9 12  2
 19 20  1
 26 27  2
  7 28  1
M  END
$$$$
tpls\mol-169.tpl
XXCombChem10310515113D                 0.00000

 28 31999 V2000
    1.5000   -1.7200    5.0000 C   0  0  0
    1.0000   -1.5800    3.7200 C   0  0  0
    0.5200   -2.4000    5.7200 C   0  0  0
    2.6800   -1.3200    5.6600 C   0  0  0
    1.5600   -0.9800    2.5600 C   0  0  0
   -0.2000   -2.1800    3.7000 N   0  0  0
   -0.4800   -2.6600    4.8800 N   0  0  0
    0.6800   -2.7200    7.0800 C   0  0  0
    2.8600   -1.6200    7.0400 C   0  0  0
    0.9400   -0.9200    1.3600 N   0  0  0
    2.6600   -0.4400    2.6400 O   0  0  0
    1.8600   -2.3200    7.7400 C   0  0  0
    1.4400   -0.3200    0.1400 C   0  0  3
    0.4400   -0.5800   -1.0400 C   0  0  0
    1.7800    1.1800    0.3800 C   0  0  0
   -0.9400   -0.1400   -0.6800 N   0  0  0
    0.6000    2.0800    0.5600 N   0  0  0
   -2.0400   -1.0800   -1.1200 C   0  0  0
   -1.2600    1.2800   -1.0000 C   0  0  0
   -0.1800    2.3600   -0.7000 C   0  0  0
    1.0000    3.3400    1.2200 C   0  0  0
   -2.5200   -1.9400    0.0000 C   0  0  0
   -1.6400   -2.8200    0.6800 C   0  0  0
   -3.8800   -1.9000    0.4200 C   0  0  0
   -2.1200   -3.6200    1.7200 C   0  0  0
   -4.3000   -2.7200    1.4800 C   0  0  0
   -3.4200   -3.5400    2.1000 N   0  0  0
   -1.3000   -3.1400    5.1000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  8 12  1
 10 13  1
 13 14  1
 13 15  1
 14 16  1
 15 17  1
 16 18  1
 16 19  1
 17 20  1
 17 21  1
 18 22  1
 22 23  1
 22 24  2
 23 25  2
 24 26  1
 25 27  1
  6  7  1
  9 12  2
 19 20  1
 26 27  2
  7 28  1
M  END
$$$$
tpls\mol-17.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
    0.4000   -0.2400   -0.1800 C   0  0  0
   -0.9200   -0.0800    0.2800 C   0  0  0
    1.0400    1.0000   -0.1200 C   0  0  0
    1.1200   -1.3600   -0.6400 C   0  0  0
   -1.0000    1.2800    0.5800 C   0  0  0
   -1.9600   -1.0000    0.4200 C   0  0  0
    0.1600    1.9000    0.3400 N   0  0  0
    2.3800    1.1600   -0.5200 C   0  0  0
    2.4800   -1.2200   -1.0400 C   0  0  0
   -1.9200   -2.4400    0.1000 C   0  0  0
   -3.0600   -0.6400    0.8600 O   0  0  0
    0.3800    3.3000    0.5600 C   0  0  0
    3.1000    0.0400   -0.9800 C   0  0  0
   -1.5200   -3.3000    1.3400 C   0  0  0
   -2.4400   -3.1400    2.4600 N   0  0  0
   -3.7400   -3.4200    2.4400 C   0  0  0
   -2.1000   -2.7000    3.6600 C   0  0  0
   -4.2800   -3.1600    3.6400 N   0  0  0
   -3.2800   -2.7200    4.4200 C   0  0  0
   -3.4200   -2.3200    5.8200 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
 10 14  1
 14 15  1
 15 16  1
 15 17  1
 16 18  2
 17 19  2
 19 20  1
  5  7  1
  9 13  2
 18 19  1
M  END
$$$$
tpls\mol-170.tpl
XXCombChem10310515113D                 0.00000

 29 32999 V2000
    1.5000   -1.7200    5.0000 C   0  0  0
    1.0000   -1.5800    3.7200 C   0  0  0
    0.5200   -2.4000    5.7200 C   0  0  0
    2.6800   -1.3200    5.6600 C   0  0  0
    1.5600   -0.9800    2.5600 C   0  0  0
   -0.2000   -2.1800    3.7000 N   0  0  0
   -0.4800   -2.6600    4.8800 N   0  0  0
    0.6800   -2.7200    7.0800 C   0  0  0
    2.8600   -1.6200    7.0400 C   0  0  0
    0.9400   -0.9200    1.3600 N   0  0  0
    2.6600   -0.4400    2.6400 O   0  0  0
    1.8600   -2.3200    7.7400 C   0  0  0
    1.4400   -0.3200    0.1400 C   0  0  3
    0.4400   -0.5800   -1.0400 C   0  0  0
    1.7800    1.1800    0.3800 C   0  0  0
   -0.9400   -0.1400   -0.6800 N   0  0  0
    0.6000    2.0800    0.5600 N   0  0  0
   -2.0400   -1.0800   -1.1200 C   0  0  0
   -1.2600    1.2800   -1.0000 C   0  0  0
   -0.1800    2.3600   -0.7000 C   0  0  0
    1.0000    3.3400    1.2200 C   0  0  0
   -2.5200   -1.9400    0.0000 C   0  0  0
   -1.6400   -2.8200    0.6800 C   0  0  0
   -3.8800   -1.9000    0.4200 C   0  0  0
   -2.0800   -3.6200    1.7200 C   0  0  0
   -4.3200   -2.7200    1.4800 C   0  0  0
   -3.4400   -3.5800    2.1200 C   0  0  0
   -1.2600   -4.4200    2.3400 F   0  0  0
   -1.3000   -3.1400    5.1000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  8 12  1
 10 13  1
 13 14  1
 13 15  1
 14 16  1
 15 17  1
 16 18  1
 16 19  1
 17 20  1
 17 21  1
 18 22  1
 22 23  1
 22 24  2
 23 25  2
 24 26  1
 25 27  1
 25 28  1
  6  7  1
  9 12  2
 19 20  1
 26 27  2
  7 29  1
M  END
$$$$
tpls\mol-171.tpl
XXCombChem10310515113D                 0.00000

 23 27999 V2000
   -4.9200    1.7400   -1.5600 C   0  0  0
   -6.3400    1.7800   -1.5800 C   0  0  0
   -4.0400    1.1200   -0.6400 C   0  0  0
   -4.5400    2.4800   -2.6800 C   0  0  0
   -6.7200    2.5400   -2.7000 C   0  0  0
   -7.3200    1.2200   -0.7400 C   0  0  0
   -2.8000    0.6600   -0.9200 N   0  0  0
   -4.2600    0.9200    0.6800 N   0  0  0
   -5.6200    2.9400   -3.3400 N   0  0  0
   -8.0800    2.7600   -3.0000 C   0  0  0
   -8.6800    1.4400   -1.0400 C   0  0  0
   -2.3400    0.1600    0.2200 C   0  0  0
   -3.2200    0.3400    1.2000 O   0  0  0
   -5.5400    3.7400   -4.5200 C   0  0  0
   -9.0600    2.2000   -2.1600 C   0  0  0
   -0.9800   -0.4600    0.4000 C   0  0  3
   -0.1600   -0.6000   -0.9400 C   0  0  0
   -0.0600    0.2000    1.4800 C   0  0  0
    1.0800   -1.5400   -0.6400 C   0  0  0
    0.4400    0.7600   -1.3800 C   0  0  0
    1.3400    0.4200    0.9600 N   0  0  0
    1.9200   -0.9000    0.5200 C   0  0  0
    1.2800    1.3600   -0.2200 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  5  9  1
 11 15  2
 12 13  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-172.tpl
XXCombChem10310515113D                 0.00000

 23 27999 V2000
    5.6800   -1.0800    0.3800 C   0  0  0
    6.6800   -2.0200    0.0200 C   0  0  0
    4.2600   -1.1400    0.2800 C   0  0  0
    6.4000    0.0200    0.8600 C   0  0  0
    7.9200   -1.4400    0.3000 C   0  0  0
    6.6000   -3.3200   -0.5200 C   0  0  0
    3.4400   -0.1000    0.0800 N   0  0  0
    3.5200   -2.2400    0.3600 N   0  0  0
    7.7400   -0.2200    0.8200 N   0  0  0
    9.1200   -2.1400    0.0400 C   0  0  0
    7.7800   -4.0200   -0.7800 C   0  0  0
    2.2200   -0.6000    0.0600 C   0  0  0
    2.2600   -1.9200    0.2400 O   0  0  0
    8.7200    0.7000    1.2400 C   0  0  0
    9.0400   -3.4400   -0.5000 C   0  0  0
    0.9600    0.1800   -0.1200 C   0  0  3
    0.0400    0.2800    1.0800 N   0  0  0
    0.1000   -0.2200   -1.4000 C   0  0  0
   -0.7800   -0.9800    1.2600 C   0  0  0
   -0.9400    1.4400    0.8600 C   0  0  0
   -1.4200   -0.1600   -1.0600 C   0  0  0
   -1.7000   -1.2400    0.0400 C   0  0  0
   -1.7600    1.2400   -0.4600 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  5  9  1
 11 15  2
 12 13  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-173.tpl
XXCombChem10310515113D                 0.00000

 17 19999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2800   -1.1200 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7600   -0.0600   -1.6200 C   0  0  0
    6.5200   -0.9000   -0.6600 N   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
  5  9  1
 11 15  2
 12 13  1
M  END
$$$$
tpls\mol-174.tpl
XXCombChem10310515113D                 0.00000

 18 20999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.6000   -0.1200    0.1600 N   0  0  0
    2.5800    0.9400   -1.4600 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.5000    0.5600   -0.5600 C   0  0  0
    3.8600    1.2000   -1.5600 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.9400    0.6000   -0.3000 C   0  0  0
    6.2600    1.1600    1.0400 N   0  0  0
    5.5400    0.3600    2.0800 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
  5  9  1
 11 15  2
 12 13  1
M  END
$$$$
tpls\mol-175.tpl
XXCombChem10310515113D                 0.00000

 19 21999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2800   -1.1200 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7600   -0.0600   -1.6200 C   0  0  0
    6.6000    1.1600   -1.8800 N   0  0  0
    5.9600    2.1200   -2.7800 C   0  0  0
    6.9000    1.9000   -0.6600 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 17 19  1
  5  9  1
 11 15  2
 12 13  1
M  END
$$$$
tpls\mol-176.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    3.9800    1.4600   -0.9600 C   0  0  0
    4.4200    0.2000   -1.1400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    4.7600    2.6800   -1.2000 C   0  0  0
    4.1600    3.6800   -2.1800 N   0  3  0
    4.0400    3.1800   -3.5400 C   0  0  0
    2.8400    4.1800   -1.7800 C   0  0  0
    5.0000    4.8800   -2.2800 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 17 19  1
 17 20  1
  5  9  1
 11 15  2
 12 13  1
M  END
$$$$
tpls\mol-177.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
   -5.3200   -0.4600    0.7800 C   0  0  0
   -6.5800    0.0600    0.4400 C   0  0  0
   -4.0400    0.1600    0.7800 C   0  0  0
   -5.5600   -1.8000    1.1400 C   0  0  0
   -7.5200   -0.9800    0.5800 C   0  0  0
   -7.0000    1.3400    0.0200 C   0  0  0
   -2.8600   -0.4600    0.5600 N   0  0  0
   -3.7800    1.4600    1.0200 N   0  0  0
   -6.8800   -2.0800    1.0000 N   0  0  0
   -8.8800   -0.7600    0.3200 C   0  0  0
   -8.3600    1.5600   -0.2600 C   0  0  0
   -1.9200    0.4800    0.6600 C   0  0  0
   -2.5000    1.6600    0.9400 O   0  0  0
   -7.4600   -3.3600    1.2800 C   0  0  0
   -9.3000    0.5200   -0.1200 C   0  0  0
   -0.4600    0.2600    0.5000 C   0  0  0
    0.1400    1.1000   -0.6800 C   0  0  0
   -0.1000   -1.2600    0.3000 C   0  0  0
    1.6600    0.8400   -0.8400 C   0  0  0
    1.4200   -1.4600    0.1000 C   0  0  0
    1.9400   -0.6200   -1.0200 N   0  0  0
    3.3600   -0.8800   -1.3000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 21 22  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-178.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
   -2.9400    1.4400    3.6800 C   0  0  0
   -4.1000    1.4600    4.4600 C   0  0  0
   -2.5800    0.5800    2.6000 C   0  0  0
   -2.1400    2.4800    4.1800 C   0  0  0
   -3.9600    2.5000    5.4000 C   0  0  0
   -5.2800    0.6800    4.4600 C   0  0  0
   -1.7800    0.9000    1.5600 N   0  0  0
   -2.9600   -0.7000    2.4400 N   0  0  0
   -2.7600    3.0800    5.2000 N   0  0  0
   -4.9600    2.7600    6.3600 C   0  0  0
   -6.3000    0.9600    5.4000 C   0  0  0
   -1.7000   -0.1800    0.8000 C   0  0  0
   -2.4400   -1.1800    1.3400 O   0  0  0
   -2.2200    4.1800    5.9400 C   0  0  0
   -6.1400    2.0000    6.3400 C   0  0  0
   -0.9200   -0.3000   -0.4800 C   0  0  3
   -0.1800    1.0200   -0.8400 C   0  0  0
    0.0600   -1.5000   -0.5000 C   0  0  0
    1.0600    1.2200   -0.0400 N   0  0  0
    1.4000   -1.2400    0.2600 C   0  0  0
    2.0400    0.1000   -0.1600 C   0  0  0
    1.7000    2.5200   -0.3000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-18.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
   -0.9200   -0.0800    0.2800 C   0  0  0
    0.4000   -0.2400   -0.1800 C   0  0  0
   -1.0000    1.2800    0.5800 C   0  0  0
   -1.9600   -1.0000    0.4200 C   0  0  0
    1.0400    1.0000   -0.1200 C   0  0  0
    1.1200   -1.3600   -0.6400 C   0  0  0
    0.1600    1.9000    0.3400 N   0  0  0
   -3.3600   -0.7800    0.9200 C   0  0  0
   -1.7400   -2.1800    0.1200 O   0  0  0
    2.3800    1.1600   -0.5200 C   0  0  0
    2.4800   -1.2200   -1.0400 C   0  0  0
    0.3800    3.3000    0.5600 C   0  0  0
   -4.2200   -2.1000    0.9200 C   0  0  0
   -3.4600   -0.1200    2.3200 C   0  0  0
   -4.0200    0.2800    0.0200 C   0  0  0
    3.1000    0.0400   -0.9800 C   0  0  0
   -4.4400   -2.6800   -0.3800 N   0  0  0
   -5.4200   -2.4000   -1.2600 C   0  0  0
   -3.6600   -3.6200   -0.9400 C   0  0  0
   -5.2800   -3.1600   -2.3600 N   0  0  0
   -6.5200   -1.4600   -1.1000 C   0  0  0
   -4.2000   -3.9200   -2.1800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  4  8  1
  4  9  2
  5 10  2
  6 11  1
  7 12  1
  8 13  1
  8 14  1
  8 15  1
 10 16  1
 13 17  1
 17 18  1
 17 19  1
 18 20  2
 18 21  1
 19 22  2
  5  7  1
 11 16  2
 20 22  1
M  END
$$$$
tpls\mol-180.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.4800    0.4200    0.2400 C   0  0  0
   -6.7200   -0.2200    0.2800 C   0  0  0
   -4.1600   -0.1000    0.3600 C   0  0  0
   -5.7800    1.7800    0.0400 C   0  0  0
   -7.7000    0.7600    0.1000 C   0  0  0
   -7.1000   -1.5600    0.4800 C   0  0  0
   -3.0400    0.4000   -0.2200 N   0  0  0
   -3.8000   -1.2000    1.0600 N   0  0  0
   -7.1000    1.9600   -0.0400 N   0  0  0
   -9.0800    0.4400    0.1000 C   0  0  0
   -8.4600   -1.9000    0.4600 C   0  0  0
   -2.0400   -0.4000    0.1400 C   0  0  0
   -2.5200   -1.3800    0.9400 O   0  0  0
   -7.7400    3.2200   -0.2400 C   0  0  0
   -9.4600   -0.9200    0.2800 C   0  0  0
   -0.6200   -0.2400   -0.2600 C   0  0  3
   -0.0600    1.1800    0.0800 C   0  0  0
    0.3000   -1.3400    0.3400 C   0  0  0
    1.4000    1.3600   -0.3200 N   0  3  0
    1.7800   -1.1600   -0.0600 C   0  0  0
    2.2800    0.2800    0.2600 C   0  0  0
    1.8800    2.7000    0.1400 C   0  0  0
    1.5600    1.4600   -1.8000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
 19 23  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-181.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2600   -1.1400 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7000   -0.0600   -1.6000 C   0  0  0
    6.7000    1.0000   -1.9400 C   0  0  0
    6.1200   -1.3600   -1.8000 C   0  0  0
    8.1400    0.6000   -2.1200 N   0  0  0
    7.4200   -1.7800   -2.3600 C   0  0  0
    8.2400   -0.6200   -2.9600 C   0  0  0
    8.9000    0.5200   -0.8600 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 16 18  2
 17 19  1
 18 20  1
 19 21  1
 19 22  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-182.tpl
XXCombChem10310515113D                 0.00000

 21 24999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2600   -1.1400 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7000   -0.0600   -1.6000 C   0  0  0
    6.1400   -1.3600   -1.8000 C   0  0  0
    6.7000    1.0000   -1.9400 C   0  0  0
    7.4200   -1.7600   -2.3400 C   0  0  0
    8.1400    0.5800   -2.0800 N   0  0  0
    8.2000   -0.6000   -3.0000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  2
 16 18  1
 17 19  1
 18 20  1
 19 21  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-183.tpl
XXCombChem10310515113D                 0.00000

 24 28999 V2000
   -5.8200    0.5800    0.3600 C   0  0  0
   -7.0800    0.2400    0.8600 C   0  0  0
   -4.5800   -0.1000    0.4000 C   0  0  0
   -6.0200    1.8400   -0.2600 C   0  0  0
   -7.9600    1.2800    0.5600 C   0  0  0
   -7.5600   -0.8800    1.5600 C   0  0  0
   -3.3600    0.4600    0.4200 N   0  0  0
   -4.4200   -1.4400    0.4400 N   0  0  0
   -7.3000    2.2400   -0.1200 N   0  0  0
   -9.3200    1.2200    0.9400 C   0  0  0
   -8.9000   -0.9600    1.9600 C   0  0  0
   -2.4800   -0.5400    0.4600 C   0  0  0
   -3.1400   -1.7200    0.4800 O   0  0  0
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   -9.7800    0.1000    1.6600 C   0  0  0
   -1.0000   -0.4000    0.5000 C   0  0  0
   -0.2800   -1.2600   -0.6000 C   0  0  0
   -0.5400    1.1000    0.4800 C   0  0  0
    1.2200   -0.8400   -0.8000 C   0  0  3
    0.9800    1.2600    0.1600 C   0  0  3
    1.3600    0.6000   -1.1000 N   0  0  0
    2.0600   -0.9200    0.5000 C   0  0  0
    1.9000    0.4800    1.1400 C   0  0  0
    0.7600    1.1000   -2.3600 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
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 10 15  1
 12 16  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
 22 23  1
M  END
$$$$
tpls\mol-184.tpl
XXCombChem10310515113D                 0.00000

 22 26999 V2000
    0.1000    0.5200   -0.2400 C   0  0  3
   -0.9800   -0.2600   -1.0800 C   0  0  0
    0.9600   -0.3600    0.3000 O   0  0  0
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    3.1800   -1.0400    0.5000 C   0  0  0
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    3.0200   -2.1200    1.3800 C   0  0  0
    5.1600   -2.0400    0.9800 C   0  0  0
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    6.5600   -2.2600    0.9400 C   0  0  0
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    4.3600   -3.8200    2.5000 C   0  0  0
    7.3600   -1.4200    0.1600 C   0  0  0
  1  2  1
  1  3  1
  1  4  1
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  2  6  1
  2  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  7 12  1
  8 13  1
 13 14  1
 13 15  2
 14 16  1
 14 17  2
 15 18  1
 16 19  2
 17 20  1
 18 21  1
 19 22  1
  8 10  2
  9 11  1
  9 12  1
 16 18  1
 20 22  2
M  END
$$$$
tpls\mol-185.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    0.2800    0.3600   -0.2000 C   0  0  0
    1.6000   -0.0200    0.0400 C   0  0  0
    0.0400    1.4600    0.6200 C   0  0  0
   -0.6600   -0.2000   -1.0600 C   0  0  0
    2.1000    0.8400    1.0400 C   0  0  0
    2.4200   -1.0200   -0.5000 C   0  0  0
    1.1200    1.7000    1.3800 N   0  0  0
   -1.4400    2.4000    0.6400 S   0  0  0
   -2.0800    0.1800   -1.0000 C   0  0  3
   -0.3400   -1.1000   -1.8400 O   0  0  0
    3.4200    0.6800    1.5200 C   0  0  0
    3.7400   -1.1800   -0.0200 C   0  0  0
    1.2400    2.7200    2.3600 C   0  0  0
   -2.2400    1.7200   -0.8400 C   0  0  0
   -2.8600   -0.6200    0.0800 C   0  0  0
    4.2400   -0.3200    0.9800 C   0  0  0
   -4.2800   -0.2800    0.1400 N   0  0  0
   -5.2000   -0.4000   -0.8400 C   0  0  0
   -4.9000    0.2000    1.2200 C   0  0  0
   -6.4000    0.0200   -0.4000 N   0  0  0
   -5.0000   -0.9000   -2.2000 C   0  0  0
   -6.2400    0.3800    0.8800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 11 16  1
 15 17  1
 17 18  1
 17 19  1
 18 20  2
 18 21  1
 19 22  2
  5  7  1
  9 14  1
 12 16  2
 20 22  1
M  END
$$$$
tpls\mol-186.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    0.3600    0.2800    0.2600 C   0  0  0
    1.5600   -0.4400    0.3800 C   0  0  0
    0.7200    1.5000   -0.3600 C   0  0  0
   -0.9000   -0.2000    0.7000 C   0  0  0
    2.5800    0.3200   -0.1800 C   0  0  0
    1.8600   -1.7200    0.9200 C   0  0  0
    2.0600    1.4600   -0.6400 N   0  0  0
   -0.1800    2.9400   -0.7400 S   0  0  0
   -2.2600    0.1400    0.2600 C   0  0  3
   -0.8800   -1.0600    1.5800 O   0  0  0
    3.9200   -0.1600   -0.2000 C   0  0  0
    3.2000   -2.2000    0.9000 C   0  0  0
    2.8200    2.4800   -1.2800 C   0  0  0
   -1.8400    2.6600   -0.0800 C   0  0  0
   -3.0000   -1.1000   -0.3200 C   0  0  0
   -2.4600    1.3800   -0.6600 C   0  0  0
    4.2200   -1.4200    0.3400 C   0  0  0
   -2.9000   -2.3000    0.5000 N   0  0  0
   -2.3600   -3.4800    0.1800 C   0  0  0
   -3.3000   -2.3800    1.7800 C   0  0  0
   -2.4400   -4.3200    1.2200 N   0  0  0
   -1.7600   -3.9000   -1.1000 C   0  0  0
   -3.0200   -3.6600    2.2200 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
  9 16  1
 11 17  1
 15 18  1
 18 19  1
 18 20  1
 19 21  2
 19 22  1
 20 23  2
  5  7  1
 12 17  2
 14 16  1
 21 23  1
M  END
$$$$
tpls\mol-187.tpl
XXCombChem10310515113D                 0.00000

 26 28  0  0  1  0999 V2000
    4.3720    6.2610    5.7120 C   0  0  1
    4.1540    6.2620    7.2600 C   0  0  0
    3.2490    7.1140    5.0340 C   0  0  0
    5.7290    6.5760    5.3160 N   0  0  0
    3.7910    7.6390    7.8900 C   0  0  2
    2.9170    8.4680    5.7310 C   0  0  1
    6.8820    5.9070    5.5420 C   0  0  0
    2.5930    8.1540    7.1570 N   0  0  0
    4.9130    8.7170    7.8510 C   0  0  0
    4.0330    9.5530    5.6990 C   0  0  0
    8.2100    6.2790    5.2180 C   0  0  0
    6.7060    4.8270    6.0930 O   0  0  0
    1.6580    9.0510    7.8820 C   0  0  0
    5.1610    9.1910    6.5160 O   0  0  0
    9.3440    5.4250    5.3820 C   0  0  0
    8.4960    7.5770    4.7160 C   0  0  0
   10.6450    5.8650    5.0460 C   0  0  0
    9.2020    4.2400    5.8250 O   0  0  0
    9.7920    8.0210    4.3790 C   0  0  0
   10.8990    7.1570    4.5400 C   0  0  0
    9.8810    3.1360    6.1320 C   0  0  0
    9.9450    9.6090    3.7950 Cl  0  0  0
   12.1850    7.5080    4.2370 N   0  0  0
    4.2160    5.2380    5.3490 H   0  0  0
    3.5550    7.4450    8.9420 H   0  0  0
    2.0440    8.8770    5.2100 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  3  6  1
  4  7  1
  5  8  1
  5  9  1
  6 10  1
  7 11  1
  7 12  2
  8 13  1
  9 14  1
 11 15  1
 11 16  2
 15 17  2
 15 18  1
 16 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  6  8  1
 10 14  1
 19 20  2
  1 24  1
  5 25  1
  6 26  1
M  END
$$$$
tpls\mol-188.tpl
XXCombChem10310515113D                 0.00000

 25 27  0  0  1  0999 V2000
   -1.1950    0.6240    1.5820 C   0  0  1
   -2.0670    1.9170    1.4650 C   0  0  0
   -2.1080   -0.6440    1.5350 C   0  0  0
   -0.0600    0.5630    0.6870 N   0  0  0
   -3.2110    1.8620    0.4070 C   0  0  2
   -3.2520   -0.6100    0.4780 C   0  0  1
    0.9990   -0.2760    0.6980 C   0  0  0
   -4.0520    0.6450    0.6280 N   0  0  0
   -2.7660    1.8040   -1.0820 C   0  0  0
   -2.7970   -0.6560   -1.0080 C   0  0  0
    2.0000   -0.2520   -0.2100 N   0  0  0
    1.0270   -1.0870    1.6130 O   0  0  0
   -5.1030    0.6930    1.6750 C   0  0  0
   -2.1330    0.5540   -1.4120 O   0  0  0
    3.1700   -0.9740   -0.4210 C   0  0  0
    4.0380   -0.6850   -1.5190 C   0  0  0
    3.5750   -2.0350    0.4310 C   0  0  0
    5.2260   -1.4220   -1.7300 C   0  0  0
    3.7380    0.2520   -2.3240 O   0  0  0
    4.7550   -2.7720    0.2270 C   0  0  0
    5.5840   -2.4620   -0.8590 C   0  0  0
    4.1000    0.9260   -3.4140 C   0  0  0
   -0.7420    0.6730    2.5790 H   0  0  0
   -3.8090    2.7740    0.5070 H   0  0  0
   -3.8810   -1.4930    0.6290 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  3  6  1
  4  7  1
  5  8  1
  5  9  1
  6 10  1
  7 11  1
  7 12  2
  8 13  1
  9 14  1
 11 15  1
 15 16  1
 15 17  2
 16 18  2
 16 19  1
 17 20  1
 18 21  1
 19 22  1
  6  8  1
 10 14  1
 20 21  2
  1 23  1
  5 24  1
  6 25  1
M  END
$$$$
tpls\mol-189.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    8.2030    5.4670    4.1650 C   0  0  0
    7.7170    5.1310    5.4330 C   0  0  0
    7.1480    5.2420    3.2670 C   0  0  0
    9.4420    5.9430    3.6870 C   0  0  0
    6.4450    4.7400    5.2240 N   0  0  0
    8.3060    5.1560    6.6910 C   0  0  0
    6.0960    4.7970    3.9780 N   0  0  0
    7.3100    5.4870    1.8880 C   0  0  0
    9.6100    6.1890    2.3100 C   0  0  0
    7.7000    4.7890    7.8360 N   0  0  0
    9.4680    5.5340    6.7470 O   0  0  0
    4.7990    4.4350    3.5090 C   0  0  0
    8.5480    5.9620    1.4140 C   0  0  0
    8.2260    4.8120    9.1820 C   0  0  1
    8.5620    6.2420    9.7150 C   0  0  0
    7.3690    4.0510   10.2460 C   0  0  0
    7.3870    7.0020   10.3990 C   0  0  2
    6.2280    4.8780   10.9120 C   0  0  1
    6.8590    6.1110   11.4790 N   0  0  0
    6.2140    7.4160    9.4640 C   0  0  0
    5.0520    5.3000    9.9840 C   0  0  0
    6.2290    6.7420   12.6660 C   0  0  0
    5.4570    6.2810    9.0120 O   0  0  0
    9.1660    4.2520    9.1110 H   0  0  0
    7.8140    7.9180   10.8200 H   0  0  0
    5.8130    4.2480   11.7050 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
 14 10  1
 14 15  1
 14 16  1
 15 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 13  2
 18 19  1
 21 23  1
 14 24  1
 17 25  1
 18 26  1
M  END
$$$$
tpls\mol-19.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    7.3450   10.7530    5.2830 C   0  0  1
    5.9750   10.7780    4.6450 N   0  0  0
    7.2440   10.0810    6.7050 C   0  0  0
    8.3650   10.1370    4.2830 C   0  0  0
    5.5280    9.3500    4.4230 C   0  0  3
    4.9990   11.4980    5.5420 C   0  0  0
    5.7700    9.6210    6.9730 C   0  0  2
    7.9850    8.7200    3.7620 C   0  0  2
    5.3550    8.6440    5.8210 C   0  0  0
    6.4750    8.6620    3.3950 C   0  0  0
    4.9240   10.8110    6.8330 C   0  0  0
    8.2930    7.6970    4.5740 O   0  0  0
    4.1970   11.2110    7.7310 O   0  0  0
    9.2690    7.1690    5.1380 C   0  0  0
    9.1380    6.0190    5.9220 C   0  0  0
   10.3590    7.7020    4.9720 O   0  0  0
    7.9050    5.3310    6.0440 C   0  0  0
   10.2320    5.4650    6.6350 C   0  0  0
    7.7390    4.1720    6.8340 C   0  0  0
   10.1260    4.3100    7.4400 C   0  0  0
    8.8660    3.6810    7.5260 C   0  0  0
    6.4180    3.5080    6.9160 C   0  0  0
   11.3100    3.7920    8.1630 C   0  0  0
    7.6780   11.7880    5.4240 H   0  0  0
    5.6760    9.1430    7.9520 H   0  0  0
    8.5560    8.5310    2.8460 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  7  3  1
  4  8  1
  5  9  1
  5 10  1
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  8 12  1
 11 13  2
 12 14  1
 14 15  1
 14 16  2
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 19 22  1
 20 23  1
  7  9  1
  7 11  1
  8 10  1
 20 21  2
  1 24  1
  7 25  1
  8 26  1
M  END
$$$$
tpls\mol-190.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
    8.7400   11.2400   10.1730 C   0  0  0
    8.6380    9.9220    9.8080 N   0  0  0
   10.0890   11.6100   10.3350 C   0  0  0
    7.7510   12.2280   10.3990 C   0  0  0
    9.9680    9.3860    9.7360 C   0  0  0
    7.5290    9.1820    9.5330 C   0  0  0
   11.0140   10.4920   10.0630 C   0  0  0
   10.4500   12.9240   10.7090 C   0  0  0
    8.0980   13.5390   10.7730 C   0  0  0
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    6.4320    9.7200    9.5990 O   0  0  0
   11.9390   10.8180    8.8510 C   0  0  0
   11.8740   10.1510   11.3190 C   0  0  0
    9.4510   13.8870   10.9280 C   0  0  0
    6.3610    7.0430    8.8340 C   0  0  1
    5.6370    7.4830    7.5200 C   0  0  0
    6.6500    5.5070    8.7750 C   0  0  0
    6.2120    6.8890    6.2000 C   0  0  2
    7.1970    4.9740    7.4160 C   0  0  1
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    8.6210    5.4530    7.0100 C   0  0  0
    6.0960    4.5620    5.1420 C   0  0  0
    8.6480    6.8550    6.6880 O   0  0  0
    5.6590    7.1750    9.6660 H   0  0  0
    5.5270    7.1910    5.4010 H   0  0  0
    7.2280    3.8830    7.5030 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
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 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  5  7  1
  9 14  2
 19 20  1
 22 24  1
 15 25  1
 18 26  1
 19 27  1
M  END
$$$$
tpls\mol-191.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
    1.1600   -0.5800   -0.7600 C   0  0  0
    1.5600    0.0200    0.4400 C   0  0  0
   -0.1600   -0.4000   -1.3800 C   0  0  0
    2.1800   -1.3200   -1.2000 N   0  0  0
    0.7200    0.9200    1.2400 C   0  0  0
    2.8000   -0.4000    0.6800 N   0  0  0
   -1.2200    0.2600   -0.4200 C   0  0  3
    3.1800   -1.2000   -0.3200 C   0  0  0
   -0.5800    1.3600    0.4600 C   0  0  0
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   -4.6600   -3.1600   -0.4800 C   0  0  0
   -3.2400   -3.4000    1.4800 C   0  0  0
   -5.4800   -4.2000    0.0000 C   0  0  0
   -4.9200   -2.5600   -1.5800 O   0  0  0
   -4.0600   -4.4400    1.9600 C   0  0  0
   -5.1800   -4.8400    1.2200 C   0  0  0
   -5.8800   -2.6800   -2.5200 C   0  0  0
    3.3600   -0.1400    1.4600 H   0  0  0
  4  8  2
  5  9  1
  7 10  1
 10 11  1
 10 12  2
 11 13  1
 13 14  1
 13 15  2
 14 16  2
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 15 18  1
 16 19  1
 17 20  1
  6  8  1
  7  9  1
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  1  2  2
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  6 21  1
M  END
$$$$
tpls\mol-192.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
    1.3600    0.4000   -0.5400 C   0  0  0
    1.5800   -0.6800    0.3200 C   0  0  0
    0.0400    1.0000   -0.7800 C   0  0  0
    2.5400    0.7400   -1.0800 N   0  0  0
    0.5200   -1.3600    1.1000 C   0  0  0
    2.9000   -0.9600    0.3000 N   0  0  0
   -1.0200    0.5800    0.2800 C   0  0  3
    3.4800   -0.0800   -0.5600 C   0  0  0
   -0.9000   -0.9600    0.6000 C   0  0  0
   -2.3800    0.9800   -0.0800 C   0  0  0
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   -3.2200    0.1000   -0.2200 O   0  0  0
   -3.9200    2.9400   -0.6200 C   0  0  0
   -4.1400    4.2600   -0.1200 C   0  0  0
   -4.8800    2.3400   -1.4400 C   0  0  0
   -5.3400    4.9200   -0.4800 C   0  0  0
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   -6.0800    3.0000   -1.7800 C   0  0  0
   -6.3000    4.3000   -1.2800 C   0  0  0
   -3.1400    6.0000    1.2400 C   0  0  0
   -1.9000    6.7000    0.7000 C   0  0  0
    3.3600   -1.6400    0.8000 H   0  0  0
  4  8  2
  5  9  1
  7 10  1
 10 11  1
 10 12  2
 11 13  1
 13 14  1
 13 15  2
 14 16  2
 14 17  1
 15 18  1
 16 19  1
 17 20  1
 20 21  1
  6  8  1
  7  9  1
 18 19  2
  1  2  2
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  6 22  1
M  END
$$$$
tpls\mol-193.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.9600   -2.6000   -0.3400 C   0  0  0
   -4.7400   -1.8800   -0.3200 C   0  0  0
   -7.0600   -2.2000    0.4600 C   0  0  0
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   -6.9200   -1.0600    1.3000 C   0  0  0
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   -7.1200   -4.4400   -1.2800 C   0  0  0
   -3.3800    0.0600    0.6200 C   0  0  0
   -5.7000   -0.3600    1.3200 C   0  0  0
   -3.5200   -3.2000   -1.9200 C   0  0  0
   -8.1800   -0.5000    2.3000 Cl  0  0  0
   -8.3800   -4.0800   -0.4400 C   0  0  0
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    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 10 15  1
 10 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  7 11  2
  9 14  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-194.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -6.0000   -2.5600    0.4000 C   0  0  0
   -4.7400   -1.8800    0.3200 C   0  0  0
   -7.1200   -2.1000   -0.3800 C   0  0  0
   -6.2200   -3.6800    1.2000 N   0  0  0
   -4.5800   -0.7200   -0.5200 C   0  0  0
   -3.7000   -2.2600    0.9400 O   0  0  0
   -6.9400   -1.0200   -1.2800 C   0  0  0
   -8.3600   -2.7000   -0.2200 N   0  0  0
   -7.3600   -4.5200    1.0600 C   0  0  0
   -3.3800    0.0600   -0.6200 C   0  0  0
   -5.7000   -0.3600   -1.3200 C   0  0  0
   -3.4600   -2.9000    2.1000 C   0  0  0
   -8.1800   -0.4200   -2.2800 Cl  0  0  0
   -8.6200   -3.6800    0.7800 C   0  0  0
   -2.1000   -0.3800   -0.4400 N   0  0  0
   -3.5000    1.2400   -0.8800 O   0  0  0
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
    0.8200   -1.4800   -0.0400 C   0  0  0
    1.5200    0.5600   -1.3400 C   0  0  0
    1.0000    0.7600    1.1400 N   0  0  0
    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 10 15  1
 10 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  7 11  2
  9 14  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-195.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -5.5000   -3.5600   -1.6400 C   0  0  0
   -4.5800   -2.5200   -1.3000 C   0  0  0
   -5.7600   -4.6200   -0.7600 C   0  0  0
   -6.0800   -3.5400   -2.7800 O   0  0  0
   -3.9200   -2.5200   -0.0200 C   0  0  0
   -4.3400   -1.5400   -2.1000 O   0  0  0
   -5.1200   -4.6400    0.5000 C   0  0  0
   -6.6600   -5.6000   -1.1600 N   0  0  0
   -6.9600   -4.4000   -3.3200 C   0  0  0
   -4.2200   -3.6000    0.8400 C   0  0  0
   -3.0000   -1.5200    0.4000 C   0  0  0
   -4.7600   -1.2000   -3.3200 C   0  0  0
   -5.3600   -5.8600    1.6400 Cl  0  0  0
   -7.3200   -5.6000   -2.4200 C   0  0  0
   -2.1800   -0.7800   -0.4000 N   0  0  0
   -2.9200   -1.2800    1.6000 O   0  0  0
   -1.2400    0.2400    0.0200 C   0  0  3
   -0.2000   -0.3000    1.0600 C   0  0  3
   -0.5800    0.9200   -1.2200 C   0  0  0
    0.8000    0.8400    1.4000 C   0  0  0
    0.6400   -1.5600    0.6400 C   0  0  0
    0.6600    1.8000   -0.8600 C   0  0  0
    1.5600    1.2000    0.1600 N   0  0  0
    1.7200   -1.3000   -0.4600 C   0  0  0
    2.4400    0.0800   -0.2800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 11 15  1
 11 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
 23 25  1
  7 10  2
  9 14  1
 22 23  1
 24 25  1
M  END
$$$$
tpls\mol-196.tpl
XXCombChem10310515113D                 0.00000

 26 29999 V2000
   -3.7400   -4.1200    3.9200 C   0  0  0
   -3.1800   -3.2800    2.9000 C   0  0  0
   -4.8800   -3.7000    4.6600 C   0  0  0
   -3.1000   -5.2000    4.1200 O   0  0  0
   -3.7000   -1.9600    2.6400 C   0  0  0
   -2.1800   -3.6400    2.1800 O   0  0  0
   -5.3600   -2.3800    4.4400 C   0  0  0
   -5.5400   -4.5200    5.5800 N   0  0  0
   -3.0200   -6.3000    4.8800 C   0  0  0
   -3.2000   -1.0600    1.6400 C   0  0  0
   -4.7800   -1.5600    3.4600 C   0  0  0
   -1.1200   -4.4400    2.3800 C   0  0  0
   -6.6800   -1.7200    5.2800 Cl  0  0  0
   -5.3600   -5.9400    5.7600 C   0  0  0
   -3.9200   -6.3200    6.1200 C   0  0  0
   -1.9200   -0.9800    1.1800 N   0  0  0
   -4.0000   -0.2800    1.1400 O   0  0  0
   -1.4000   -0.0800    0.1800 C   0  0  3
   -0.2600   -0.8000   -0.7000 C   0  0  3
   -1.0200    1.3400    0.8200 C   0  0  0
    0.3400    0.3600   -1.5200 C   0  0  0
    0.9600   -1.6000   -0.0400 C   0  0  0
    0.1800    2.1400    0.1600 C   0  0  0
    0.9400    0.9200   -0.2200 N   0  0  0
    2.4000   -0.8600   -0.0800 C   0  0  0
    2.4200    0.7200   -0.2600 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 10 16  1
 10 17  2
 16 18  1
 18 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
 24 26  1
  7 11  2
 14 15  1
 23 24  1
 25 26  1
M  END
$$$$
tpls\mol-197.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -1.7200    0.0200   -0.5200 C   0  0  0
   -0.3600   -0.3000   -0.2600 C   0  0  0
   -2.7000   -0.9200   -0.5000 N   0  0  0
   -2.2800    1.2800   -0.8000 C   0  0  0
    0.5400    0.6400    0.3600 C   0  0  0
    0.1200   -1.5800   -0.6200 C   0  0  0
   -3.9200   -0.4400   -0.7600 C   0  0  0
   -4.0000    1.2800   -1.0600 S   0  0  0
    1.8800    0.2600    0.5800 C   0  0  0
    0.0800    1.8000    0.6400 O   0  0  0
    1.4600   -1.9400   -0.3800 C   0  0  0
   -5.1200   -1.3000   -0.8200 C   0  0  0
    2.3400   -1.0200    0.2400 C   0  0  0
    0.6000    2.9000    1.2000 C   0  0  0
   -5.3600   -2.0400    0.4600 C   0  0  0
   -4.5200   -2.9400    1.1200 C   0  0  0
   -6.4800   -1.9000    1.1800 N   0  0  0
   -5.1800   -3.3200    2.2200 N   0  0  0
   -3.1800   -3.3800    0.7000 C   0  0  0
   -6.3600   -2.7000    2.2600 C   0  0  0
   -4.8600   -3.9400    2.9000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  4  8  1
  5  9  2
  5 10  1
  6 11  1
  7 12  1
  9 13  1
 10 14  1
 12 15  1
 15 16  2
 15 17  1
 16 18  1
 16 19  1
 17 20  2
  7  8  1
 11 13  2
 18 20  1
 18 21  1
M  END
$$$$
tpls\mol-198.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
    1.8800    0.2200   -0.3600 C   0  0  0
    0.5000    0.3400   -0.1200 C   0  0  0
    2.8000    1.0600    0.1800 N   0  0  0
    2.6600   -0.9800   -1.3800 S   0  0  0
   -0.3800   -0.7800   -0.1600 C   0  0  0
   -0.0400    1.6200    0.1400 C   0  0  0
    4.0800    0.8200   -0.1400 C   0  0  0
    4.1800   -0.2800   -0.9800 C   0  0  0
   -1.7600   -0.6000    0.0600 C   0  0  0
    0.1200   -1.9400   -0.4000 O   0  0  0
   -1.4200    1.8000    0.3600 C   0  0  0
    5.2000    1.6200    0.3600 C   0  0  0
   -2.2800    0.6800    0.3400 C   0  0  0
   -0.3400   -3.1800   -0.5000 C   0  0  0
    5.3200    1.6200    1.8600 C   0  0  0
    4.3600    2.0400    2.7800 C   0  0  0
    6.3600    1.1800    2.5600 N   0  0  0
    4.8600    1.8400    4.0000 N   0  0  0
    3.0400    2.5800    2.5200 C   0  0  0
    6.0800    1.3200    3.8600 C   0  0  0
    7.2000    0.8200    2.2000 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  4  8  1
  5  9  2
  5 10  1
  6 11  1
  7 12  1
  9 13  1
 10 14  1
 12 15  1
 15 16  2
 15 17  1
 16 18  1
 16 19  1
 17 20  1
  7  8  2
 11 13  2
 18 20  2
 17 21  1
M  END
$$$$
tpls\mol-199.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
   10.3400    9.1890   -7.2750 C   0  0  0
   11.2180    8.9690   -8.3490 C   0  0  0
    9.1120    8.6750   -7.6070 N   0  0  0
   10.8370    9.8590   -6.1300 C   0  0  0
   10.5270    8.3290   -9.3140 N   0  0  0
   12.5670    9.3840   -8.2910 C   0  0  0
    9.2940    8.1700   -8.8380 C   0  0  0
    7.9770    8.6640   -6.8520 C   0  0  0
   12.1780   10.2830   -6.0630 C   0  0  0
   11.0260    7.8940  -10.5960 C   0  0  0
   13.0430   10.0420   -7.1440 C   0  0  0
    8.4620    7.5800   -9.5150 O   0  0  0
    6.7340    8.2680   -7.2010 N   0  0  0
    8.0490    9.0640   -5.6970 O   0  0  0
   11.2740    6.3730  -10.6760 C   0  0  0
    5.5290    8.1690   -6.4030 C   0  0  1
    4.1980    8.0170   -7.2160 C   0  0  0
    5.6360    7.0480   -5.3160 C   0  0  0
    3.7700    6.5400   -7.4870 C   0  0  2
    5.0870    5.6620   -5.7770 C   0  0  1
    3.6780    5.7720   -6.2230 N   0  0  0
    4.7990    5.6390   -8.2080 C   0  0  0
    5.7040    5.0940   -7.0780 C   0  0  0
    2.5700    5.9830   -5.2650 C   0  0  0
    5.4480    9.1380   -5.8960 H   0  0  0
    2.8220    6.5300   -8.0330 H   0  0  0
    5.1910    4.9380   -4.9630 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  7 12  2
  8 13  1
  8 14  2
 10 15  1
 16 13  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
  5  7  1
  9 11  2
 20 21  1
 22 23  1
 16 25  1
 19 26  1
 20 27  1
M  END
$$$$
tpls\mol-2.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    0.2600    0.1200   -0.1200 C   0  0  0
    1.6000   -0.2400   -0.1800 C   0  0  0
    0.1800    1.1800    0.7800 C   0  0  0
   -0.8600   -0.3800   -0.8000 C   0  0  0
    2.3000    0.6200    0.6600 C   0  0  0
    2.2800   -1.2400   -0.9200 C   0  0  0
    1.4200    1.4800    1.2200 N   0  0  0
   -1.1000    1.8400    1.1200 C   0  0  0
   -2.2000    0.2000   -0.6000 C   0  0  3
   -0.7200   -1.3000   -1.5800 O   0  0  0
    3.7000    0.5200    0.8000 C   0  0  0
    3.6800   -1.3600   -0.7800 C   0  0  0
    1.7400    2.5200    2.1400 C   0  0  0
   -2.3200    0.9400    0.8000 C   0  0  0
   -3.3800   -0.8400   -0.7600 C   0  0  0
   -2.3800    1.2600   -1.7200 C   0  0  0
    4.3800   -0.4800    0.0800 C   0  0  0
   -3.4800   -1.8400    0.2800 N   0  0  0
   -4.1200   -1.7600    1.4600 C   0  0  0
   -2.9000   -3.0600    0.2200 C   0  0  0
   -3.9600   -2.9000    2.1600 N   0  0  0
   -4.8800   -0.6200    1.9800 C   0  0  0
   -3.2200   -3.7200    1.4000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
  9 16  1
 11 17  1
 15 18  1
 18 19  1
 18 20  1
 19 21  2
 19 22  1
 20 23  2
  5  7  1
  9 14  1
 12 17  2
 21 23  1
M  END
$$$$
tpls\mol-20.tpl
XXCombChem10310515113D                 0.00000

 16 18  0  0  1  0999 V2000
    4.8620    3.7740    3.8280 N   0  0  0
    3.8900    4.3880    4.8100 C   0  0  3
    4.3770    4.0740    2.4270 C   0  0  1
    4.9450    2.2830    4.0400 C   0  0  0
    2.4890    3.6800    4.6620 C   0  0  0
    3.9160    5.9380    4.6660 C   0  0  0
    2.9900    3.3610    2.1970 C   0  0  0
    4.4300    5.6090    2.1790 C   0  0  0
    3.6200    1.6880    3.8460 C   0  0  0
    2.5440    2.6240    3.5060 C   0  0  1
    3.6440    6.4490    3.2240 C   0  0  1
    3.4350    0.4850    3.9650 O   0  0  0
    2.2300    6.4760    2.9880 O   0  0  0
    5.0950    3.6490    1.7160 H   0  0  0
    1.5770    2.1310    3.3730 H   0  0  0
    3.9820    7.4900    3.1700 H   0  0  0
  1  2  1
  1  3  1
  1  4  1
  2  5  1
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  9 12  2
 11 13  1
 10  7  1
  8 11  1
  9 10  1
  3 14  1
 10 15  1
 11 16  1
M  END
$$$$
tpls\mol-200.tpl
XXCombChem10310515113D                 0.00000

 27 30  0  0  1  0999 V2000
    7.9210    8.9170   10.6940 C   0  0  0
    7.9050   10.2880   10.3930 C   0  0  0
    7.2170    8.2660    9.7240 N   0  0  0
    8.6140    8.4760   11.8460 C   0  0  0
    7.1910   10.4490    9.2570 N   0  0  0
    8.5710   11.2180   11.2210 C   0  0  0
    6.7980    9.2300    8.8950 C   0  0  0
    6.9780    6.9410    9.6130 C   0  0  0
    9.2760    9.3980   12.6780 C   0  0  0
    6.9000   11.6820    8.5710 C   0  0  0
    9.2550   10.7690   12.3640 C   0  0  0
    6.0890    9.0530    7.9110 O   0  0  0
    6.3830    6.4580    8.6340 O   0  0  0
    7.3260    6.1430   10.4720 O   0  0  0
    7.6700   11.8490    7.2430 C   0  0  0
    5.9340    5.2990    8.1260 C   0  0  1
    5.1450    5.6110    6.8170 C   0  0  0
    7.0490    4.2310    7.8890 C   0  0  0
    6.0250    5.5850    5.5270 C   0  0  2
    7.7470    4.3500    6.4990 C   0  0  1
    6.7550    4.3020    5.3990 N   0  0  0
    7.2490    6.5310    5.5110 C   0  0  0
    8.3830    5.7250    6.1860 C   0  0  0
    6.0600    3.0480    5.0320 C   0  0  0
    5.2290    4.9130    8.8700 H   0  0  0
    5.3940    5.7780    4.6540 H   0  0  0
    8.4960    3.5580    6.3980 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  6 11  1
  7 12  2
  8 13  1
  8 14  2
 10 15  1
 16 13  1
 16 17  1
 16 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
  5  7  1
  9 11  2
 20 21  1
 22 23  1
 16 25  1
 19 26  1
 20 27  1
M  END
$$$$
tpls\mol-201.tpl
XXCombChem10310515113D                 0.00000

 23 26  0  0  1  0999 V2000
   -3.9800   -1.2000    1.1400 C   0  0  0
   -3.2000   -1.3600   -0.0200 C   0  0  0
   -5.1200   -2.0400    0.9800 C   0  0  0
   -3.8400   -0.4400    2.3200 C   0  0  0
   -1.9800   -0.7400   -0.3800 C   0  0  0
   -3.9000   -2.2600   -0.8200 C   0  0  0
   -5.0200   -2.6600   -0.2200 N   0  0  0
   -6.1000   -2.1200    1.9800 C   0  0  0
   -4.8400   -0.5200    3.3200 C   0  0  0
   -1.2200    0.2600    0.4200 C   0  0  1
   -1.4800   -1.0400   -1.4600 O   0  0  0
   -5.9400   -3.5800   -0.7600 C   0  0  0
   -5.9600   -1.3400    3.1400 C   0  0  0
   -0.1600   -0.4000    1.3800 C   0  0  0
   -0.5800    1.3600   -0.4600 C   0  0  0
    1.1600   -0.5800    0.7600 C   0  0  0
    0.7200    0.9200   -1.2400 C   0  0  0
    1.5600    0.0200   -0.4400 C   0  0  0
    2.1800   -1.3200    1.2000 N   0  0  0
    2.8000   -0.4000   -0.6800 N   0  0  0
    3.1800   -1.2000    0.3200 C   0  0  0
   -1.9200    0.7800    1.0800 H   0  0  0
    3.3600   -0.1400   -1.4600 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
 10  5  1
  5 11  2
  7 12  1
  8 13  1
 10 14  1
 10 15  1
 14 16  1
 15 17  1
 16 18  2
 16 19  1
 18 20  1
 19 21  2
  6  7  1
  9 13  2
 17 18  1
 20 21  1
 10 22  1
 20 23  1
M  END
$$$$
tpls\mol-202.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
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   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2600   -1.1400 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7200   -0.0600   -1.6000 C   0  0  0
    6.1800   -1.1600   -2.3400 C   0  0  0
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    7.5000   -1.0000   -2.5400 N   0  0  0
    5.4400   -2.3200   -2.8600 C   0  0  0
    7.8800    0.1400   -1.9400 C   0  0  0
    8.1000   -1.6000   -3.0200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  2
 16 18  1
 17 19  1
 17 20  1
 18 21  2
  5  9  1
 11 15  2
 12 13  1
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-203.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
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   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2800   -1.1200 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7600   -0.0600   -1.6200 C   0  0  0
    6.6000   -0.8800   -0.6000 C   0  0  0
    5.9600   -2.1800   -0.2600 C   0  0  0
    5.0200   -2.4600    0.7400 C   0  0  0
    6.2200   -3.3400   -0.9000 N   0  0  0
    4.7400   -3.7600    0.6600 N   0  0  0
    4.4200   -1.5000    1.7000 C   0  0  0
    5.4600   -4.2800   -0.3400 C   0  0  0
    4.1200   -4.2600    1.2200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  9  1
 11 15  2
 12 13  1
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-204.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.6000   -0.1200    0.1600 N   0  0  0
    2.5800    0.9400   -1.4600 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.5000    0.5600   -0.5600 C   0  0  0
    3.8600    1.2000   -1.5600 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.9400    0.6000   -0.3000 C   0  0  0
    6.2800    1.1600    1.0400 C   0  0  0
    5.8800    0.6400    2.2600 C   0  0  0
    7.0200    2.2400    1.2600 N   0  0  0
    6.4000    1.4400    3.2000 N   0  0  0
    7.1000    2.4000    2.5800 C   0  0  0
    6.3000    1.3400    4.1600 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  2
 17 19  1
 18 20  1
 19 21  2
  5  9  1
 11 15  2
 12 13  1
 20 21  1
 20 22  1
M  END
$$$$
tpls\mol-205.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2800   -1.1200 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.7600   -0.0600   -1.6200 C   0  0  0
    6.0400    0.4800   -3.0600 C   0  0  0
    5.1000    0.0000   -4.0200 N   0  0  0
    5.3800   -0.7400   -5.1000 C   0  0  0
    3.7600    0.1800   -3.9800 C   0  0  0
    4.1800   -1.0000   -5.7400 C   0  0  0
    3.1800   -0.4200   -5.0400 N   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 18 19  1
 18 20  1
 19 21  2
 20 22  2
  5  9  1
 11 15  2
 12 13  1
 21 22  1
M  END
$$$$
tpls\mol-206.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
   -1.0400   -0.7800    0.5000 C   0  0  0
   -0.6600    1.3400   -0.6000 C   0  0  0
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    3.6000   -0.1200    0.1600 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    3.9000    1.1800   -1.5200 C   0  0  0
    4.5200    0.5200   -0.5000 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    4.5800    2.0200   -2.5200 C   0  0  0
    4.4200    1.5000   -3.9800 C   0  0  0
    3.0400    1.4800   -4.4000 N   0  0  0
    2.1600    0.4600   -4.2800 C   0  0  0
    2.4000    2.5000   -5.0000 C   0  0  0
    0.9600    0.8400   -4.7800 N   0  0  0
    2.3800   -0.8600   -3.7000 C   0  0  0
    1.1000    2.0800   -5.2400 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 18 19  1
 18 20  1
 19 21  2
 19 22  1
 20 23  2
  5  9  1
 11 15  2
 12 13  1
 21 23  1
M  END
$$$$
tpls\mol-207.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    1.1400   -0.4000    0.0400 C   0  0  0
   -0.1600    0.1400   -0.0600 C   0  0  0
    2.4000    0.1200   -0.4000 C   0  0  0
    0.9800   -1.6200    0.6800 C   0  0  0
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    3.4600   -0.6000   -0.8000 N   0  0  0
    2.7200    1.4200   -0.5000 N   0  0  0
   -0.3200   -1.8400    0.9600 N   0  0  0
   -2.4200   -0.5400    0.5600 C   0  0  0
   -2.0400    1.6000   -0.5400 C   0  0  0
    4.4200    0.2800   -1.1200 C   0  0  0
    3.9400    1.5200   -0.9400 O   0  0  0
   -0.8400   -3.0000    1.6000 C   0  0  0
   -2.9200    0.6800    0.0200 C   0  0  0
    5.6800   -0.0800   -1.5800 C   0  0  0
    6.1600   -1.3200   -1.7800 C   0  0  0
    7.4400   -1.6400   -2.2400 C   0  0  0
    8.4200   -0.7400   -2.5800 C   0  0  0
    7.9400   -2.8800   -2.4400 N   0  0  0
    9.5000   -1.4400   -2.9800 N   0  0  0
    9.2000   -2.7400   -2.9000 C   0  0  0
   10.3400   -1.0600   -3.2800 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  2
  6 11  1
  7 12  2
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  2
 17 18  1
 18 19  2
 18 20  1
 19 21  1
 20 22  2
  5  9  1
 11 15  2
 12 13  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-208.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.0400   -0.2800    0.9000 C   0  0  0
   -0.1200    0.1400    0.2000 C   0  0  0
    2.3000    0.3200    1.0200 C   0  0  0
    0.6600   -1.5000    1.4800 C   0  0  0
   -1.1200   -0.8400    0.3800 C   0  0  0
   -0.4000    1.2800   -0.5800 C   0  0  0
    3.3000   -0.1600    1.7000 N   0  0  0
    2.6000    1.4000    0.5000 O   0  0  0
   -0.6000   -1.8200    1.1600 N   0  0  0
   -2.4000   -0.7000   -0.1800 C   0  0  0
   -1.6800    1.4200   -1.1600 C   0  0  0
    4.4200    0.6800    1.6400 C   0  0  3
    3.8400    1.8000    0.7600 C   0  0  0
   -1.2800   -3.0000    1.6000 C   0  0  0
   -2.6800    0.4400   -0.9800 C   0  0  0
    4.8800    1.1000    3.0600 C   0  0  0
    3.8800    1.9200    3.8200 C   0  0  0
    3.3600    1.6200    5.0600 C   0  0  0
    3.3600    3.0600    3.4000 N   0  0  0
    2.5200    2.6000    5.3800 N   0  0  0
    2.5200    3.4800    4.3600 C   0  0  0
    2.0000    2.6800    6.1800 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  3  8  1
  4  9  1
  5 10  2
  6 11  1
  7 12  1
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  2
 17 19  1
 18 20  1
 19 21  2
  5  9  1
 11 15  2
 12 13  1
 20 21  1
 20 22  1
M  END
$$$$
tpls\mol-209.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
    1.0400   -0.2800    0.9000 C   0  0  0
   -0.1200    0.1400    0.2000 C   0  0  0
    2.3000    0.3200    1.0200 C   0  0  0
    0.6600   -1.5000    1.4800 C   0  0  0
   -1.1200   -0.8400    0.3800 C   0  0  0
   -0.4000    1.2800   -0.5800 C   0  0  0
    2.6400    1.4600    0.4800 N   0  0  0
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   -0.6000   -1.8200    1.1600 N   0  0  0
   -2.4000   -0.7000   -0.1800 C   0  0  0
   -1.6800    1.4200   -1.1600 C   0  0  0
    3.9800    1.8000    0.8200 C   0  0  3
    4.3400    0.5600    1.6800 C   0  0  0
   -1.2800   -3.0000    1.6000 C   0  0  0
   -2.6800    0.4400   -0.9800 C   0  0  0
    4.8200    2.0000   -0.4800 C   0  0  0
    4.9800    0.7800   -1.3200 C   0  0  0
    5.4800   -0.3800   -0.9000 N   0  0  0
    4.6200    0.6600   -2.6600 C   0  0  0
    5.4400   -1.2200   -1.9400 C   0  0  0
    4.9200   -0.5800   -3.0200 N   0  0  0
    4.7200   -1.1400   -4.3000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  3  8  1
  4  9  1
  5 10  2
  6 11  1
  7 12  1
  8 13  1
  9 14  1
 10 15  1
 12 16  1
 16 17  1
 17 18  1
 17 19  2
 18 20  2
 19 21  1
 21 22  1
  5  9  1
 11 15  2
 12 13  1
 20 21  1
M  END
$$$$
tpls\mol-21.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
    0.4000   -0.2400   -0.1800 C   0  0  0
   -0.9200   -0.0800    0.2800 C   0  0  0
    1.0400    1.0000   -0.1200 C   0  0  0
    1.1200   -1.3600   -0.6400 C   0  0  0
   -1.0000    1.2800    0.5800 C   0  0  0
   -1.9600   -1.0000    0.4200 C   0  0  0
    0.1600    1.9000    0.3400 N   0  0  0
    2.3800    1.1600   -0.5200 C   0  0  0
    2.4800   -1.2200   -1.0400 C   0  0  0
   -1.9200   -2.4400    0.1000 C   0  0  0
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    0.3800    3.3000    0.5600 C   0  0  0
    3.1000    0.0400   -0.9800 C   0  0  0
   -2.3000   -2.7400   -1.3600 C   0  0  0
   -1.4000   -2.0400   -2.3400 C   0  0  0
   -0.2400   -2.5000   -2.9400 C   0  0  0
   -1.6400   -0.8000   -2.7800 N   0  0  0
    0.2000   -1.5200   -3.7400 N   0  0  0
    0.3800   -3.8200   -2.7800 C   0  0  0
   -0.6600   -0.4800   -3.6400 C   0  0  0
    0.9800   -1.5400   -4.3000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
 10 14  1
 14 15  1
 15 16  2
 15 17  1
 16 18  1
 16 19  1
 17 20  2
  5  7  1
  9 13  2
 18 20  1
 18 21  1
M  END
$$$$
tpls\mol-210.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.9600   -2.5800   -0.3400 C   0  0  0
   -4.7200   -1.8800   -0.3200 C   0  0  0
   -7.0400   -2.1800    0.4600 C   0  0  0
   -6.3600   -3.7800   -1.1000 C   0  0  0
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   -6.9200   -1.0600    1.3000 C   0  0  0
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   -7.8200   -4.0400   -0.6600 C   0  0  0
   -3.3800    0.0600    0.6200 C   0  0  0
   -5.7000   -0.3600    1.3200 C   0  0  0
   -3.5200   -3.2200   -1.9200 C   0  0  0
   -8.2200   -0.5600    2.2600 Cl  0  0  0
   -2.1000   -0.3800    0.4400 N   0  0  0
   -3.5000    1.2400    0.8800 O   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
 10 14  1
 10 15  2
 14 16  1
 16 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 11  2
  8  9  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-211.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.7600   -1.7000    2.8600 C   0  0  0
   -4.5400   -1.5400    2.1600 C   0  0  0
   -6.9800   -1.1400    2.3600 C   0  0  0
   -5.8400   -2.4800    4.1400 C   0  0  0
   -4.5000   -0.9200    0.8600 C   0  0  0
   -3.4000   -1.9000    2.6400 O   0  0  0
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   -8.1400   -1.1800    3.1000 N   0  0  0
   -7.2600   -2.8600    4.6200 C   0  0  0
   -3.3200   -0.7600    0.0600 C   0  0  0
   -5.7400   -0.4400    0.3600 C   0  0  0
   -2.8800   -2.0000    3.8600 C   0  0  0
   -8.3200    0.1600    0.3400 Cl  0  0  0
   -8.2000   -1.6400    4.4400 C   0  0  0
   -2.0600   -0.6200    0.5000 N   0  0  0
   -3.4600   -0.7600   -1.1600 O   0  0  0
   -0.8600   -0.4600   -0.3000 C   0  0  3
    0.4200   -1.1200    0.3400 C   0  0  0
   -0.5000    1.0400   -0.6200 C   0  0  0
    1.5800   -1.0600   -0.7200 C   0  0  0
    0.8800   -0.2800    1.5800 C   0  0  0
    0.9400    1.3600   -0.3400 N   0  0  0
    1.8200    0.4400   -1.1200 C   0  0  0
    1.2000    1.1800    1.1400 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 10 15  1
 10 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  7 11  2
  9 14  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-212.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -5.9400   -0.4600    2.8600 C   0  0  0
   -4.6800   -0.3600    2.1800 C   0  0  0
   -6.9200   -1.3800    2.4000 C   0  0  0
   -6.2200    0.5000    4.0000 C   0  0  0
   -4.5000   -0.9200    0.8600 C   0  0  0
   -3.6400    0.1800    2.7000 O   0  0  0
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   -7.7000    0.9000    4.2400 C   0  0  0
   -3.3200   -0.7600    0.0600 C   0  0  0
   -5.6000   -1.6600    0.3600 C   0  0  0
   -3.1600    0.3200    3.9400 C   0  0  0
   -7.9000   -2.9200    0.3200 Cl  0  0  0
   -8.1800   -1.6200    4.5800 C   0  0  0
   -8.5200   -0.1800    4.9800 C   0  0  0
   -2.0600   -0.6200    0.5000 N   0  0  0
   -3.4600   -0.7600   -1.1600 O   0  0  0
   -0.8600   -0.4600   -0.3000 C   0  0  3
    0.4200   -1.1200    0.3400 C   0  0  0
   -0.5000    1.0400   -0.6200 C   0  0  0
    1.5800   -1.0600   -0.7200 C   0  0  0
    0.8800   -0.2800    1.5800 C   0  0  0
    0.9400    1.3600   -0.3400 N   0  0  0
    1.8200    0.4400   -1.1200 C   0  0  0
    1.2000    1.1800    1.1400 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 10 16  1
 10 17  2
 16 18  1
 18 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
  7 11  2
 14 15  1
 23 24  1
 23 25  1
M  END
$$$$
tpls\mol-213.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -4.7000   -4.3800   -1.5000 C   0  0  0
   -3.7600   -3.3400   -1.2000 C   0  0  0
   -5.9000   -4.5000   -0.7600 C   0  0  0
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   -3.9200   -2.5200   -0.0200 C   0  0  0
   -2.7400   -3.1000   -1.9200 O   0  0  0
   -6.0800   -3.6800    0.3800 C   0  0  0
   -6.8800   -5.4000   -1.1400 N   0  0  0
   -5.4000   -6.5800   -2.6600 C   0  0  0
   -5.1000   -2.7400    0.7400 C   0  0  0
   -3.0000   -1.5200    0.4000 C   0  0  0
   -2.4600   -3.1800   -3.2200 C   0  0  0
   -7.4600   -3.7600    1.4000 Cl  0  0  0
   -6.8400   -6.1400   -2.3600 C   0  0  0
   -2.1800   -0.7800   -0.4000 N   0  0  0
   -2.9200   -1.2800    1.6000 O   0  0  0
   -1.2400    0.2400    0.0200 C   0  0  3
   -0.2000   -0.3000    1.0600 C   0  0  3
   -0.5800    0.9200   -1.2200 C   0  0  0
    0.8000    0.8400    1.4000 C   0  0  0
    0.6400   -1.5600    0.6400 C   0  0  0
    0.6600    1.8000   -0.8600 C   0  0  0
    1.5600    1.2000    0.1600 N   0  0  0
    1.7200   -1.3000   -0.4600 C   0  0  0
    2.4400    0.0800   -0.2800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 11 15  1
 11 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
 23 25  1
  7 10  2
  9 14  1
 22 23  1
 24 25  1
M  END
$$$$
tpls\mol-214.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -6.0200   -2.5600   -0.4000 C   0  0  0
   -4.7600   -1.8600   -0.3200 C   0  0  0
   -7.0800   -2.1800    0.4600 C   0  0  0
   -6.2200   -3.6600   -1.4000 C   0  0  0
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   -3.7200   -2.2400   -0.9800 O   0  0  0
   -6.9200   -1.0600    1.3000 C   0  0  0
   -8.3600   -2.9400    0.5200 C   0  0  0
   -7.6800   -4.1400   -1.6000 C   0  0  0
   -3.3800    0.0600    0.6200 C   0  0  0
   -5.7000   -0.3600    1.3200 C   0  0  0
   -3.2400   -3.4000   -1.4200 C   0  0  0
   -8.1400   -0.4800    2.3200 Cl  0  0  0
   -8.3800   -4.3000   -0.2400 C   0  0  0
   -2.1000   -0.3800    0.4400 N   0  0  0
   -3.5000    1.2400    0.8800 O   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 10 15  1
 10 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
  7 11  2
  9 14  1
 22 23  1
 22 24  1
M  END
$$$$
tpls\mol-215.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -5.9000   -2.8200   -0.7000 C   0  0  0
   -4.6600   -2.1400   -0.8200 C   0  0  0
   -7.0400   -2.1400   -0.2800 C   0  0  0
   -6.2000   -4.2400   -0.9400 C   0  0  0
   -4.5800   -0.7200   -0.5200 C   0  0  0
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   -7.0000   -0.7800    0.0200 C   0  0  0
   -8.2200   -3.0200   -0.2000 C   0  0  0
   -7.7000   -4.4000   -0.6200 C   0  0  0
   -3.3800    0.0600   -0.6200 C   0  0  0
   -5.7800   -0.1000   -0.1000 C   0  0  0
   -3.2800   -3.9800   -1.5800 C   0  0  0
   -8.4000    0.0600    0.5400 Cl  0  0  0
   -2.1000   -0.3800   -0.4400 N   0  0  0
   -3.5000    1.2400   -0.8800 O   0  0  0
   -0.8800    0.3800   -0.5400 C   0  0  3
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
    0.8200   -1.4800   -0.0400 C   0  0  0
    1.5200    0.5600   -1.3400 C   0  0  0
    1.0000    0.7600    1.1400 N   0  0  0
    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
 10 14  1
 10 15  2
 14 16  1
 16 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 11  2
  8  9  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-216.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -6.1200   -2.4800    0.8000 C   0  0  0
   -4.8200   -1.8600    0.8000 C   0  0  0
   -7.0600   -2.1400   -0.2200 C   0  0  0
   -6.5400   -3.4400    1.8800 C   0  0  0
   -4.5400   -0.7200   -0.0200 C   0  0  0
   -3.8200   -2.3400    1.4600 O   0  0  0
   -6.7400   -1.0800   -1.1200 C   0  0  0
   -8.3400   -2.9200   -0.3800 C   0  0  0
   -6.5400   -4.9200    1.4000 C   0  0  0
   -3.3400    0.0400    0.0600 C   0  0  0
   -5.5200   -0.3800   -0.9600 C   0  0  0
   -3.5600   -2.5800    2.7400 C   0  0  0
   -7.7600   -0.5400   -2.3600 Cl  0  0  0
   -8.1000   -4.4400   -0.6600 C   0  0  0
   -7.8200   -5.3000    0.6200 C   0  0  0
   -2.1000   -0.3800    0.4400 N   0  0  0
   -3.4000    1.2400   -0.2400 O   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  3
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 10 16  1
 10 17  2
 16 18  1
 18 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
  7 11  2
 14 15  1
 23 24  1
 23 25  1
M  END
$$$$
tpls\mol-217.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -5.5800   -3.5200   -1.6200 C   0  0  0
   -4.6200   -2.5200   -1.3000 C   0  0  0
   -5.7600   -4.6200   -0.7400 C   0  0  0
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   -5.1000   -4.6400    0.5000 C   0  0  0
   -6.6600   -5.7800   -1.0800 C   0  0  0
   -7.5800   -4.4200   -3.0000 C   0  0  0
   -4.2200   -3.6000    0.8400 C   0  0  0
   -3.0000   -1.5200    0.4000 C   0  0  0
   -4.2400   -1.4400   -3.4200 C   0  0  0
   -5.3200   -5.8600    1.6800 Cl  0  0  0
   -7.1600   -5.8200   -2.5600 C   0  0  0
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   -1.2400    0.2400    0.0200 C   0  0  3
   -0.2000   -0.3000    1.0600 C   0  0  3
   -0.5800    0.9200   -1.2200 C   0  0  0
    0.8000    0.8400    1.4000 C   0  0  0
    0.6400   -1.5600    0.6400 C   0  0  0
    0.6600    1.8000   -0.8600 C   0  0  0
    1.5600    1.2000    0.1600 N   0  0  0
    1.7200   -1.3000   -0.4600 C   0  0  0
    2.4400    0.0800   -0.2800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 11 15  1
 11 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
 23 25  1
  7 10  2
  9 14  1
 22 23  1
 24 25  1
M  END
$$$$
tpls\mol-218.tpl
XXCombChem10310515113D                 0.00000

 23 27999 V2000
   -3.3000   -1.6200   -2.2800 C   0  0  0
   -3.8800   -1.9400   -3.5000 C   0  0  0
   -4.0000   -2.3000   -1.3000 C   0  0  0
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   -1.6600   -0.2200   -2.9000 O   0  0  0
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   -4.4200   -2.0800   -5.8800 C   0  0  0
   -5.9000   -3.8600   -1.2000 C   0  0  0
   -2.4600   -1.2800    0.4200 C   0  0  0
   -0.6600    0.2800   -0.3400 C   0  0  3
   -5.4600   -2.9800   -5.5800 C   0  0  0
    0.6800   -0.0600   -1.0800 C   0  0  0
   -0.3600    0.4400    1.2000 C   0  0  0
    1.3800   -1.3200   -0.4400 C   0  0  0
    1.6600    1.1400   -0.8600 C   0  0  0
    1.1000    0.3000    1.4800 N   0  0  0
    1.5600   -1.0800    1.0800 C   0  0  0
    1.8800    1.3400    0.6800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
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  8 14  1
  9 15  1
 11 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 14  1
 12 16  2
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-219.tpl
XXCombChem10310515113D                 0.00000

 28 31  0  0  1  0999 V2000
   -5.1000   -1.5800   -2.2000 C   0  0  0
   -4.4600   -1.2600   -0.9600 C   0  0  0
   -6.4600   -1.9400   -2.2600 C   0  0  0
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   -1.0000   -0.2000    0.3200 C   0  0  1
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    1.3600   -0.8800   -0.5400 C   0  0  1
    0.7800    1.3200   -0.8000 C   0  0  2
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    1.6800    1.3200    0.4800 C   0  0  0
    2.6400    0.4400   -2.2400 C   0  0  0
    0.5600   -0.1600   -2.8400 C   0  0  0
    1.9600   -1.7600   -0.8600 H   0  0  0
    0.8800    2.2800   -1.3400 H   0  0  0
   -0.7600   -0.0200    1.3800 H   0  0  0
  3  8  1
  4  9  1
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  9 14  1
 15 10  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 18 20  1
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 22 23  1
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 20 27  1
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
 15 28  1
M  END
$$$$
tpls\mol-22.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
    0.4000   -0.2400   -0.1800 C   0  0  0
   -0.9200   -0.0800    0.2800 C   0  0  0
    1.0400    1.0000   -0.1200 C   0  0  0
    1.1200   -1.3600   -0.6400 C   0  0  0
   -1.0000    1.2800    0.5800 C   0  0  0
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    2.4800   -1.2200   -1.0400 C   0  0  0
   -1.8200   -2.4600    0.7200 C   0  0  3
   -3.1200   -0.6200    0.3000 O   0  0  0
    0.3800    3.3000    0.5600 C   0  0  0
    3.1000    0.0400   -0.9800 C   0  0  0
   -3.1600   -3.2400    0.6800 C   0  0  0
   -1.1000   -2.6600    2.0600 C   0  0  0
   -4.1400   -2.8000    1.7200 C   0  0  0
   -4.2600   -3.2400    3.0400 C   0  0  0
   -5.0800   -1.8600    1.5200 N   0  0  0
   -5.2800   -2.5600    3.5800 N   0  0  0
   -3.4400   -4.2400    3.7200 C   0  0  0
   -5.7600   -1.7400    2.6600 C   0  0  0
   -5.6000   -2.6600    4.5000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
 10 14  1
 10 15  1
 14 16  1
 16 17  2
 16 18  1
 17 19  1
 17 20  1
 18 21  2
  5  7  1
  9 13  2
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-220.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
    0.1200    0.0800   -0.0800 C   0  0  0
    1.4400   -0.3800   -0.1400 C   0  0  0
    0.1800    1.3800    0.4800 C   0  0  0
   -1.1200   -0.4400   -0.4200 C   0  0  0
    2.2600    0.6400    0.3600 C   0  0  0
    1.9800   -1.6000   -0.6000 C   0  0  0
    1.4800    1.6800    0.7200 N   0  0  0
   -0.9800    2.1000    0.6600 C   0  0  0
   -2.2600    0.3000   -0.2200 N   0  0  0
   -1.1600   -1.5800   -0.9000 O   0  0  0
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    3.3800   -1.7800   -0.5400 C   0  0  0
    1.9600    2.9000    1.2800 C   0  0  0
   -2.1600    1.5600    0.3200 C   0  0  0
   -3.5600   -0.2400   -0.5600 C   0  0  0
    4.2000   -0.7600   -0.0400 C   0  0  0
   -3.9400    0.0800   -1.9600 C   0  0  0
   -4.0800    1.3400   -2.5400 C   0  0  0
   -4.2000   -0.8400   -2.8800 N   0  0  0
   -4.4400    1.1200   -3.8200 N   0  0  0
   -3.9000    2.6600   -1.9200 C   0  0  0
   -4.5000   -0.2000   -4.0200 C   0  0  0
   -4.6200    1.8000   -4.5000 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  6 12  1
  7 13  1
  8 14  2
  9 15  1
 11 16  1
 15 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  1
  9 14  1
 12 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-222.tpl
XXCombChem10310515113D                 0.00000

 18 19999 V2000
   -1.7200    0.0200   -0.5200 C   0  0  0
   -0.3600   -0.3000   -0.2600 C   0  0  0
   -2.1600    1.2800   -0.7800 N   0  0  0
   -2.8200   -0.8600   -0.5200 C   0  0  0
    0.5400    0.6400    0.3600 C   0  0  0
    0.1200   -1.5800   -0.6200 C   0  0  0
   -3.4800    1.3800   -1.0000 C   0  0  0
   -4.3400   -0.1200   -0.8800 S   0  0  0
    1.8800    0.2600    0.5800 C   0  0  0
    0.0800    1.8000    0.6400 O   0  0  0
    1.4600   -1.9400   -0.3800 C   0  0  0
   -4.1200    2.6600   -1.3000 C   0  0  0
    2.3400   -1.0200    0.2400 C   0  0  0
    0.6000    2.9000    1.2000 C   0  0  0
   -3.6400    3.2800   -2.5000 N   0  0  0
   -2.3600    3.6600   -2.7600 C   0  0  0
   -1.3800    3.5400   -1.9000 N   0  0  0
   -2.0400    4.2200   -3.9000 N   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  4  8  1
  5  9  2
  5 10  1
  6 11  1
  7 12  1
  9 13  1
 10 14  1
 12 15  1
 15 16  1
 16 17  1
 16 18  2  3  0  0  0
  7  8  1
 11 13  2
M  END
$$$$
tpls\mol-223.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
    1.0400    0.0600   -0.5000 C   0  0  0
   -0.2200    0.0400    0.1000 C   0  0  0
    2.1400    0.9000   -0.1200 C   0  0  0
    1.0000   -0.9000   -1.5200 C   0  0  0
   -0.9800   -0.9400   -0.5600 C   0  0  0
   -0.8000    0.7600    1.1600 C   0  0  0
    3.4200    0.5200   -0.2800 N   0  0  0
    2.0800    2.1800    0.4400 C   0  0  0
   -0.2200   -1.4800   -1.5400 N   0  0  0
    2.1000   -1.2800   -2.4200 C   0  0  0
   -2.3000   -1.2200   -0.2000 C   0  0  0
   -2.1400    0.5000    1.5400 C   0  0  0
    4.3200    1.4400    0.1200 C   0  0  0
    3.6200    2.9000    0.7600 S   0  0  0
   -2.8800   -0.5000    0.8600 C   0  0  0
    5.7800    1.2200    0.0400 C   0  0  0
    6.2400    1.0200   -1.3200 N   0  0  0
    6.6400    1.9800   -2.1800 C   0  0  0
    7.0600    1.7200   -3.4000 N   0  0  0
    6.6600    3.2400   -1.8600 N   0  0  0
   -0.5000   -2.1800   -2.1400 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  4 10  1
  5 11  2
  6 12  1
  7 13  2
  8 14  1
 11 15  1
 13 16  1
 16 17  1
 17 18  1
 18 19  1
 18 20  2  3  0  0  0
  5  9  1
 12 15  2
 13 14  1
  9 21  1
M  END
$$$$
tpls\mol-224.tpl
XXCombChem10310515113D                 0.00000

 17 18999 V2000
   -1.6600   -0.0400   -0.6200 C   0  0  0
   -0.3200    0.0400   -0.1400 C   0  0  0
   -2.3000   -1.2200   -0.8400 N   0  0  0
   -2.5200    1.0200   -0.9600 C   0  0  0
    0.1200    1.1200    0.6400 C   0  0  0
    0.6000   -1.0000   -0.4600 C   0  0  0
   -3.5600   -1.1000   -1.2800 C   0  0  0
   -4.1000    0.5400   -1.5000 S   0  0  0
    1.4600    1.1800    1.1000 C   0  0  0
   -0.6800    2.1000    1.0000 F   0  0  0
    1.9200   -0.9400    0.0000 C   0  0  0
   -4.4200   -2.2600   -1.5800 C   0  0  0
    2.3600    0.1400    0.7800 C   0  0  0
   -5.6400   -2.2800   -0.8200 N   0  0  0
   -5.8200   -2.8600    0.4000 C   0  0  0
   -4.8800   -3.5200    1.0400 N   0  0  0
   -6.9800   -2.8200    1.0200 N   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  4  8  1
  5  9  2
  5 10  1
  6 11  1
  7 12  1
  9 13  1
 12 14  1
 14 15  1
 15 16  1
 15 17  2  3  0  0  0
  7  8  1
 11 13  2
M  END
$$$$
tpls\mol-225.tpl
XXCombChem10310515113D                 0.00000

 20 22999 V2000
    1.1600    0.2800   -0.3200 C   0  0  0
   -0.1400   -0.1200    0.0200 C   0  0  0
    2.3600   -0.5000   -0.4200 C   0  0  0
    1.1000    1.6600   -0.5400 C   0  0  0
   -0.9200    1.0400    0.0000 C   0  0  0
   -0.7200   -1.3600    0.3200 C   0  0  0
    2.3800   -1.8400   -0.1800 N   0  0  0
    3.9400    0.1000   -0.8600 S   0  0  0
   -0.1600    2.0800   -0.3400 N   0  0  0
   -2.3000    0.9800    0.3200 C   0  0  0
   -2.0800   -1.4400    0.6200 C   0  0  0
    3.5800   -2.4200   -0.3400 C   0  0  0
    4.5600   -1.5000   -0.7000 C   0  0  0
   -2.8800   -0.2600    0.6200 C   0  0  0
    3.8000   -3.8600   -0.1200 C   0  0  0
    3.4800   -4.3000    1.2200 N   0  0  0
    2.2800   -4.2000    1.8400 C   0  0  0
    2.0600   -4.6200    3.0600 N   0  0  0
    1.2400   -3.6600    1.2400 N   0  0  0
   -0.4600    3.0000   -0.4200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  2
  3  8  1
  4  9  1
  5 10  2
  6 11  1
  7 12  1
  8 13  1
 10 14  1
 12 15  1
 15 16  1
 16 17  1
 17 18  1
 17 19  2  3  0  0  0
  5  9  1
 11 14  2
 12 13  2
  9 20  1
M  END
$$$$
tpls\mol-226.tpl
XXCombChem10310515113D                 0.00000

 21 22999 V2000
   -0.5000    0.0200   -0.1600 C   0  0  0
    0.5200    0.6600    0.6200 C   0  0  0
   -0.1400   -1.2200   -0.7800 C   0  0  0
   -1.8200    0.5400   -0.3400 C   0  0  0
    1.8000    0.0600    0.7600 C   0  0  0
    0.2600    1.7800    1.1800 O   0  0  0
    1.1400   -1.8000   -0.6400 C   0  0  0
   -2.6200    0.3600   -1.4200 N   0  0  0
   -2.2800    1.2200    0.5600 O   0  0  0
    2.1200   -1.1600    0.1400 C   0  0  0
    0.9600    2.6200    1.9600 C   0  0  0
    1.4200   -3.3000   -1.4200 Cl  0  0  0
   -3.9400    0.8800   -1.6000 C   0  0  0
    3.3600   -1.6800    0.3000 N   0  0  0
   -3.9400    2.3600   -1.5600 C   0  0  0
   -3.3000    3.2000   -2.3600 N   0  0  0
   -4.6400    2.9800   -0.6400 N   0  0  0
   -3.5600    4.5400   -1.9600 C   0  0  0
   -2.4600    2.8800   -3.4800 C   0  0  0
   -4.5200    4.3800   -0.7600 C   0  0  0
   -1.2600    2.0200   -3.0600 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  4  8  1
  4  9  2
  5 10  1
  6 11  1
  7 12  1
  8 13  1
 10 14  1
 13 15  1
 15 16  1
 15 17  2
 16 18  1
 16 19  1
 17 20  1
 19 21  1
  7 10  2
 18 20  1
M  END
$$$$
tpls\mol-227.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
    0.2200   -0.3800   -0.1200 C   0  0  0
   -1.1000   -0.8200   -0.2400 C   0  0  0
    0.2600    0.9600   -0.0200 N   0  0  0
    1.3200   -1.2400   -0.1400 C   0  0  0
   -1.9200    0.3400   -0.1800 C   0  0  0
   -1.3400   -2.2000   -0.3600 C   0  0  0
   -1.0000    1.4000   -0.0600 C   0  0  0
    1.5000    1.6800    0.0800 C   0  0  3
    2.6800   -0.6400    0.0000 C   0  0  0
    1.0800   -2.6200   -0.2600 C   0  0  0
   -3.3200    0.4600   -0.2600 C   0  0  0
   -0.2600   -3.1000   -0.3800 C   0  0  0
    2.6600    0.7800    0.6200 C   0  0  0
    1.8400    2.3200   -1.2800 C   0  0  0
   -4.2800   -0.4200    0.1800 N   0  0  0
   -3.7600    1.4800   -0.7600 O   0  0  0
   -4.1200   -1.3000    1.3200 C   0  0  0
   -5.5600   -0.4800   -0.4800 C   0  0  0
   -3.8800   -0.5400    2.5800 C   0  0  0
   -3.7000   -1.0400    3.8600 C   0  0  0
   -3.8200    0.8000    2.6200 N   0  0  0
   -3.5200    0.0200    4.6600 N   0  0  0
   -3.7000   -2.4400    4.3000 C   0  0  0
   -3.6000    1.1400    3.9000 C   0  0  0
   -3.3600    0.0200    5.6200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  8 13  1
  8 14  1
 11 15  1
 11 16  2
 15 17  1
 15 18  1
 17 19  1
 19 20  2
 19 21  1
 20 22  1
 20 23  1
 21 24  2
  5  7  2
  9 13  1
 10 12  2
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-228.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -0.3600   -0.1600   -0.0600 C   0  0  0
    0.7600   -0.9600   -0.1200 C   0  0  0
   -0.0600    1.0600    0.4000 N   0  0  0
   -1.6600   -0.6000   -0.4000 C   0  0  0
    1.8600   -0.1800    0.3200 C   0  0  0
    0.6000   -2.3000   -0.5800 C   0  0  0
    1.2800    1.0800    0.6400 C   0  0  0
   -1.0400    2.1000    0.5600 C   0  0  0
   -1.8000   -1.9200   -0.8400 C   0  0  0
   -2.7800    0.3600   -0.2600 C   0  0  0
    3.2000   -0.5800    0.4400 C   0  0  0
   -0.6800   -2.7600   -0.9400 C   0  0  0
    1.9600    2.2600    1.2200 C   0  0  0
   -2.3200    1.8400   -0.2800 C   0  0  0
    3.9000   -1.5200   -0.3000 N   0  0  0
    3.8600   -0.0200    1.3200 O   0  0  0
    5.0200   -2.2800    0.2200 C   0  0  0
    3.5600   -1.7800   -1.6600 C   0  0  0
    6.3200   -1.5800   -0.0200 C   0  0  0
    6.8800   -1.2000   -1.2400 C   0  0  0
    7.1400   -1.1800    0.9600 N   0  0  0
    8.0400   -0.5800   -0.9600 N   0  0  0
    6.3200   -1.4000   -2.5800 C   0  0  0
    8.2000   -0.5800    0.3800 C   0  0  0
    8.6600   -0.2200   -1.6000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  7 13  1
  8 14  1
 11 15  1
 11 16  2
 15 17  1
 15 18  1
 17 19  1
 19 20  2
 19 21  1
 20 22  1
 20 23  1
 21 24  2
  5  7  2
  9 12  2
 10 14  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-229.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.5200    0.4400    0.1200 C   0  0  0
   -0.8400    0.6000    0.4200 C   0  0  0
    0.7000   -0.6800   -0.6000 N   0  0  0
    1.5000    1.3800    0.4800 C   0  0  0
   -1.5000   -0.5400   -0.0800 C   0  0  0
   -1.2600    1.7600    1.0800 C   0  0  0
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    1.0600    2.5600    1.1200 C   0  0  0
    3.1800    1.0800    0.1800 S   0  0  0
   -2.8600   -0.9000   -0.0200 C   0  0  0
   -0.3000    2.7600    1.4200 C   0  0  0
    3.1600   -0.6800   -0.2600 C   0  0  0
   -3.8000   -0.6000    0.9600 N   0  0  0
   -3.3000   -1.5600   -0.9600 O   0  0  0
   -3.4800   -0.4600    2.3600 C   0  0  0
   -5.1800   -0.4600    0.6200 C   0  0  0
   -2.8800   -1.7000    2.9200 C   0  0  0
   -2.4600   -1.9400    4.2200 C   0  0  0
   -2.6800   -2.8200    2.2000 N   0  0  0
   -2.0000   -3.2000    4.2600 N   0  0  0
   -2.5000   -1.0400    5.3600 C   0  0  0
   -2.1400   -3.7200    3.0200 C   0  0  0
   -1.6400   -3.6800    5.0200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  8 13  1
 11 14  1
 11 15  2
 14 16  1
 14 17  1
 16 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  2
  9 12  2
 10 13  1
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-23.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
   -0.4600    0.1800    0.0800 C   0  0  0
    0.9400    0.1000   -0.1200 C   0  0  0
   -0.9800   -1.1200   -0.0600 C   0  0  0
   -1.3400    1.2400    0.3400 C   0  0  0
    1.1800   -1.2800   -0.3400 C   0  0  0
    1.9000    1.1400   -0.0800 C   0  0  0
    0.0200   -1.9800   -0.3000 N   0  0  0
   -2.3600   -1.3600    0.0800 C   0  0  0
   -2.7200    1.0000    0.4800 C   0  0  0
    2.4800   -1.9400   -0.6200 C   0  0  0
    3.3400    1.0400   -0.2600 C   0  0  0
    1.5000    2.3000    0.1400 O   0  0  0
   -0.1400   -3.3800   -0.5000 C   0  0  0
   -3.2400   -0.3000    0.3600 C   0  0  0
    4.1000    0.7400    1.0600 C   0  0  0
    3.6200   -0.5200    1.7200 C   0  0  0
    4.3600   -1.6400    2.0800 C   0  0  0
    2.3600   -0.7000    2.1000 N   0  0  0
    3.5000   -2.5000    2.6600 N   0  0  0
    5.8000   -1.8800    1.8800 C   0  0  0
    2.2800   -1.9200    2.6600 C   0  0  0
    3.7200   -3.3800    3.0200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  6 11  1
  6 12  2
  7 13  1
  8 14  1
 11 15  1
 15 16  1
 16 17  2
 16 18  1
 17 19  1
 17 20  1
 18 21  2
  5  7  1
  9 14  2
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-230.tpl
XXCombChem10310515113D                 0.00000

 30 34999 V2000
   -0.7200    0.6200   -0.0600 C   0  0  0
   -0.0200   -0.5400    0.1000 N   0  0  0
   -2.0800    0.3200   -0.2400 C   0  0  0
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   -7.9200   -3.4600   -1.9000 C   0  0  0
   -7.7800   -3.6400   -3.9400 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  4 10  1
  5 11  1
  5 12  2
  6 13  1
  7 14  1
  8 15  1
  9 16  1
 11 17  2
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 14 20  2
 17 21  1
 19 22  1
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 22 24  1
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 26 29  2
  6  7  2
 10 15  2
 11 16  1
 18 21  2
 27 29  1
 27 30  1
M  END
$$$$
tpls\mol-231.tpl
XXCombChem10310515113D                 0.00000

 29 33999 V2000
    0.6200   -0.7800   -0.0800 C   0  0  0
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   -0.0600   -2.0400   -0.2200 C   0  0  0
   -1.1800    0.9800   -0.0600 C   0  0  0
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   -1.5400   -2.1000   -0.3400 C   0  0  0
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    4.8200   -0.3000    1.9600 C   0  0  0
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    4.1800    0.3000    3.1400 C   0  0  0
    4.6200    1.4200    3.7400 N   0  0  0
    3.0600   -0.1400    3.8400 C   0  0  0
    3.8000    1.6800    4.7800 C   0  0  0
    2.8400    0.7200    4.8400 N   0  0  0
    2.2400   -1.3200    3.5600 C   0  0  0
    2.1400    0.6800    5.5000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  4 10  1
  5 11  1
  5 12  2
  7 13  1
  8 14  1
  9 15  1
 11 16  2
 12 17  1
 13 18  1
 13 19  2
 16 20  1
 18 21  1
 18 22  1
 21 23  1
 23 24  1
 23 25  2
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 25 27  1
 25 28  1
  6  7  2
 10 14  2
 11 15  1
 17 20  2
 26 27  1
 27 29  1
M  END
$$$$
tpls\mol-232.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -0.0400   -0.1200   -0.2800 C   0  0  0
   -1.4200   -0.1400   -0.0200 C   0  0  0
    0.4200    1.1400   -0.1000 N   0  0  0
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   -2.1400   -1.3400   -0.1600 C   0  0  0
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   -0.0600   -2.5000   -0.7600 C   0  0  0
    2.1400   -1.2800   -0.8600 C   0  0  0
   -3.0600    1.6800    0.7000 C   0  0  0
   -1.4600   -2.5200   -0.5200 C   0  0  0
    2.8000    0.8600    0.5600 C   0  0  0
    2.9400   -0.6800    0.3200 C   0  0  0
   -4.3200    1.2600    0.3000 N   0  0  0
   -3.0600    2.6200    1.5000 O   0  0  0
   -4.6200    0.7000   -1.0000 C   0  0  0
   -5.4600    1.4400    1.1800 C   0  0  0
   -4.9800    1.7600   -1.9800 C   0  0  0
   -6.0200    2.6800   -1.9400 C   0  0  0
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   -7.0200    2.8200   -0.8800 C   0  0  0
   -4.8800    3.0000   -3.7600 C   0  0  0
   -6.5200    4.1600   -3.3000 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
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  5 11  1
  6 12  1
  8 13  1
 10 14  1
 11 15  1
 11 16  2
 15 17  1
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 17 19  1
 19 20  2
 19 21  1
 20 22  1
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 21 24  2
  5  7  2
  9 12  2
 13 14  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-233.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.3600   -0.1800   -0.1400 C   0  0  0
    0.7800   -0.9600   -0.2600 C   0  0  0
   -0.0200    1.1200    0.0000 N   0  0  0
   -1.6600   -0.6600   -0.2200 C   0  0  0
    1.8800   -0.1000   -0.1600 C   0  0  0
    0.6200   -2.3600   -0.4400 C   0  0  0
    1.3200    1.1800    0.0000 C   0  0  0
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   -1.8200   -2.0600   -0.4000 C   0  0  0
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    3.2600   -0.3800   -0.2200 C   0  0  0
   -0.7000   -2.9000   -0.5000 C   0  0  0
   -2.3800    1.6200    0.6200 C   0  0  0
    4.3000    0.5000   -0.1200 N   0  0  0
    3.6200   -1.5600   -0.3600 O   0  0  0
    5.7000    0.1600   -0.1600 C   0  0  0
    6.1000   -0.5000   -1.4400 C   0  0  0
    7.0200   -0.0600   -2.3800 C   0  0  0
    5.5600   -1.6400   -1.8800 N   0  0  0
    7.0400   -0.9800   -3.3600 N   0  0  0
    7.8800    1.1400   -2.3200 C   0  0  0
    6.1600   -1.9200   -3.0600 C   0  0  0
    7.6000   -0.9600   -4.1600 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  8 13  1
 11 14  1
 11 15  2
 14 16  1
 16 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  2
  9 12  2
 10 13  1
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-234.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -0.2400    0.2200    0.1400 C   0  0  0
    1.1400   -0.0800    0.2200 C   0  0  0
   -0.8200   -0.6600   -0.7800 C   0  0  0
   -1.0600    1.1800    0.8000 C   0  0  0
    1.3200   -1.1200   -0.6800 C   0  0  0
    2.1400    0.5000    1.0200 C   0  0  0
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    3.4600    0.1600    1.0600 N   0  0  0
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    0.0000   -2.5000   -2.2400 C   0  0  0
   -3.0000    0.3400   -0.4400 C   0  0  0
    4.4800    0.7800    1.8600 C   0  0  0
    4.6200    2.2400    1.5800 C   0  0  0
    5.7600    2.9200    1.1200 C   0  0  0
    3.6400    3.1200    1.7200 N   0  0  0
    5.4200    4.2000    1.0000 N   0  0  0
    7.0800    2.3600    0.8000 C   0  0  0
    4.1200    4.3200    1.3800 C   0  0  0
    5.9800    4.9400    0.7200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
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  6 11  2
  7 12  1
  8 13  1
 10 14  1
 14 15  1
 15 16  2
 15 17  1
 16 18  1
 16 19  1
 17 20  2
  5  7  1
  9 13  2
 18 20  1
 18 21  1
M  END
$$$$
tpls\mol-235.tpl
XXCombChem10310515113D                 0.00000

 22 24999 V2000
   -0.2400    0.2200    0.1400 C   0  0  0
    1.1400   -0.0800    0.2200 C   0  0  0
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   -1.0600    1.1800    0.8000 C   0  0  0
    1.3200   -1.1200   -0.6800 C   0  0  0
    2.1400    0.5000    1.0200 C   0  0  0
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   -2.4400    1.2200    0.5000 C   0  0  0
    2.2600    1.8000    1.4600 N   0  0  0
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    0.0000   -2.5000   -2.2400 C   0  0  0
   -3.0000    0.3400   -0.4400 C   0  0  0
    1.7600    2.9600    0.7400 C   0  0  0
    2.9400    2.1000    2.7000 C   0  0  0
    2.4000    3.0800   -0.6000 C   0  0  0
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    0.3400    2.9600   -2.1400 C   0  0  0
    3.9200    3.3200   -2.1200 C   0  0  0
    2.6400    3.2600   -3.7200 H   0  0  0
  1  2  1
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 10 15  1
 14 16  1
 16 17  2
 16 18  1
 17 19  1
 17 20  1
 18 21  2
  5  7  1
  9 13  2
 19 21  1
 19 22  1
M  END
$$$$
tpls\mol-236.tpl
XXCombChem10310515113D                 0.00000

 19 21  0  0  1  0999 V2000
    1.0600   -1.1400    0.7000 C   0  0  1
    1.0800    0.0400    1.5800 N   0  0  0
   -0.4000   -1.4600    0.2000 C   0  0  0
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   -5.5000   -1.0400   -2.2000 C   0  0  0
   -5.1200   -1.0400   -3.5600 C   0  0  0
    1.4800   -2.0200    1.2000 H   0  0  0
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   -0.6800   -0.2400   -1.5400 H   0  0  0
  1  2  1
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 11 12  1
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 13 15  1
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  5  8  1
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 15 16  2
  1 17  1
  5 18  1
  7 19  1
M  END
$$$$
tpls\mol-237.tpl
XXCombChem10310515113D                 0.00000

 20 22  0  0  1  0999 V2000
    1.0600   -1.1400    0.7000 C   0  0  1
    1.0800    0.0400    1.5800 N   0  0  0
   -0.4000   -1.4600    0.2000 C   0  0  0
    2.0000   -0.6600   -0.4200 C   0  0  0
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    0.3600   -0.0200    2.8800 C   0  0  0
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   -6.9000   -1.2400   -1.8000 C   0  0  0
    1.4800   -2.0200    1.2000 H   0  0  0
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   -0.6800   -0.2400   -1.5400 H   0  0  0
  1  2  1
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 11 12  1
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 13 15  1
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  5  8  1
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 15 16  2
  1 18  1
  5 19  1
  7 20  1
M  END
$$$$
tpls\mol-239.tpl
XXCombChem10310515113D                 0.00000

 20 22  0  0  1  0999 V2000
    1.0600   -1.1400    0.7000 C   0  0  1
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   -5.1200   -1.0400   -3.5600 C   0  0  0
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   -0.6800   -0.2400   -1.5400 H   0  0  0
  1  2  1
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 15 16  2
  1 18  1
  5 19  1
  7 20  1
M  END
$$$$
tpls\mol-240.tpl
XXCombChem10310515113D                 0.00000

 15 17999 V2000
    0.9400    0.2200   -0.4800 C   0  0  3
   -0.0200    1.1200    0.3400 C   0  0  0
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    4.3800    0.2800    0.7000 N   0  0  0
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    5.6600    0.6000    0.4200 C   0  0  0
    5.9800    1.1400   -0.8400 C   0  0  0
  1  2  1
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 11 13  2
 12 14  1
 13 15  1
  8  9  1
  8 10  1
 14 15  2
M  END
$$$$
tpls\mol-241.tpl
XXCombChem10310515113D                 0.00000

 25 28  0  0  1  0999 V2000
   -5.8400   -1.0600   -0.3400 C   0  0  0
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    0.8800   -0.2800   -1.5800 C   0  0  0
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    1.2000    1.1800   -1.1400 C   0  0  0
   -1.0400   -0.9800    1.2400 H   0  0  0
  1  2  1
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  4  9  1
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 17 13  1
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 18 21  1
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 21 24  1
  8 10  2
 12 15  1
 22 23  1
 22 24  1
 17 25  1
M  END
$$$$
tpls\mol-242.tpl
XXCombChem10310515113D                 0.00000

 24 27  0  0  1  0999 V2000
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   -5.4200   -3.2600    0.2400 C   0  0  0
   -8.2600   -0.3800    3.1200 C   0  0  0
   -7.3600   -0.1600    4.3400 C   0  0  0
   -0.8800    0.3800    0.5400 C   0  0  1
   -5.4000   -4.5800   -0.8200 Cl  0  0  0
    0.3400   -0.4400    1.1000 C   0  0  0
   -0.4400    1.0200   -0.8400 C   0  0  0
    0.8200   -1.4800    0.0400 C   0  0  0
    1.5200    0.5600    1.3400 C   0  0  0
    1.0000    0.7600   -1.1400 N   0  0  0
    1.2200   -0.7200   -1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
   -1.0800    1.1800    1.2400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  9 14  1
 15 10  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
 13 14  1
 21 22  1
 21 23  1
 15 24  1
M  END
$$$$
tpls\mol-243.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -5.8200   -1.6000   -0.9000 C   0  0  0
   -4.4000   -1.6200   -1.1200 C   0  0  0
   -6.6800   -2.7000   -1.2000 C   0  0  0
   -6.2600   -0.4800   -0.4600 O   0  0  0
   -3.4800   -0.6200   -0.7200 C   0  0  0
   -3.9200   -2.7800   -1.8200 C   0  0  0
   -6.1000   -3.8000   -1.9000 C   0  0  0
   -8.0200   -2.7400   -0.8200 N   0  0  0
   -7.3200    0.2600   -0.1400 C   0  0  0
   -2.1800   -0.7800   -0.4000 N   0  0  0
   -3.9000    0.5400   -0.6600 O   0  0  0
   -4.7400   -3.8400   -2.2200 C   0  0  0
   -6.8600   -4.8800   -2.2800 N   0  0  0
   -8.7200   -1.8400    0.0800 C   0  0  0
   -8.6800   -0.3800   -0.4400 C   0  0  0
   -1.2400    0.2400    0.0200 C   0  0  3
   -3.9600   -5.1000   -3.0600 Cl  0  0  0
   -0.2000   -0.3000    1.0600 C   0  0  3
   -0.5800    0.9200   -1.2200 C   0  0  0
    0.8000    0.8400    1.4000 C   0  0  0
    0.6400   -1.5600    0.6400 C   0  0  0
    0.6600    1.8000   -0.8600 C   0  0  0
    1.5600    1.2000    0.1600 N   0  0  0
    1.7200   -1.3000   -0.4600 C   0  0  0
    2.4400    0.0800   -0.2800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  7 13  1
  8 14  1
  9 15  1
 10 16  1
 12 17  1
 16 18  1
 16 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 21 24  1
 23 25  1
  7 12  2
 14 15  1
 22 23  1
 24 25  1
M  END
$$$$
tpls\mol-244.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -0.3600   -0.1800   -0.1400 C   0  0  0
    0.7800   -0.9600   -0.2600 C   0  0  0
   -0.0200    1.1200    0.0000 N   0  0  0
   -1.6600   -0.6600   -0.2200 C   0  0  0
    1.8800   -0.1000   -0.1600 C   0  0  0
    0.6200   -2.3600   -0.4400 C   0  0  0
    1.3200    1.1800    0.0000 C   0  0  0
   -0.9800    2.1600    0.1400 C   0  0  0
   -1.8200   -2.0600   -0.4000 C   0  0  0
   -2.8000    0.3000   -0.1000 C   0  0  0
    3.2600   -0.3800   -0.2200 C   0  0  0
   -0.7000   -2.9000   -0.5000 C   0  0  0
   -2.3800    1.6200    0.6200 C   0  0  0
    3.9400   -1.5200    0.2000 N   0  0  0
    4.0000    0.5000   -0.6600 O   0  0  0
    3.5000   -2.3600    1.3000 C   0  0  0
    5.1600   -1.9200   -0.4600 C   0  0  0
    3.4600   -1.6000    2.5800 C   0  0  0
    3.1000   -2.0800    3.8400 C   0  0  0
    3.7800   -0.3000    2.6800 N   0  0  0
    3.2200   -1.0400    4.6800 N   0  0  0
    2.7000   -3.4200    4.2200 C   0  0  0
    3.6200    0.0400    3.9800 C   0  0  0
    3.0400   -1.0400    5.6400 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  1
  5 11  1
  6 12  1
  8 13  1
 11 14  1
 11 15  2
 14 16  1
 14 17  1
 16 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  5  7  2
  9 12  2
 10 13  1
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-245.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
   -3.3800    2.9600    3.0200 C   0  0  0
   -3.1600    1.7600    2.4000 N   0  0  0
   -3.9000    2.7200    4.3000 C   0  0  0
   -3.2000    4.3000    2.6200 C   0  0  0
   -3.5200    0.7800    3.2800 C   0  0  0
   -2.6600    1.4800    1.1400 C   0  0  0
   -3.9800    1.3400    4.4600 C   0  0  0
   -4.2400    3.7600    5.1800 C   0  0  0
   -3.5400    5.3600    3.4800 C   0  0  0
   -2.4400    0.1600    0.5400 C   0  0  0
   -2.3400    2.4000    0.4000 O   0  0  0
   -4.4600    0.6000    5.6400 C   0  0  0
   -4.0400    5.0800    4.7600 C   0  0  0
   -0.9600   -0.1600    0.1800 C   0  0  0
   -0.4000    0.7400   -0.9800 C   0  0  0
   -0.0400   -0.1000    1.4600 C   0  0  0
    1.1600    0.7000   -1.0600 C   0  0  3
    1.4800   -0.0400    1.1000 C   0  0  3
    1.6800    1.1600    0.2600 N   0  0  0
    1.7400   -0.7200   -1.2400 C   0  0  0
    1.9600   -1.2200    0.2000 C   0  0  0
    3.0600    1.7000    0.2400 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  8 13  1
 10 14  1
 14 15  1
 14 16  1
 15 17  1
 16 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
  5  7  2
  9 13  2
 18 19  1
 20 21  1
M  END
$$$$
tpls\mol-246.tpl
XXCombChem10310515113D                 0.00000

 23 27999 V2000
   -6.2200   -1.9000   -1.7200 C   0  0  0
   -6.3600   -1.9200   -0.2600 C   0  0  0
   -4.9600   -1.0800   -2.0000 C   0  0  0
   -6.7200   -3.0000   -2.6600 C   0  0  0
   -7.4800   -1.6600   -2.5800 C   0  0  0
   -5.3200   -1.1400    0.2800 C   0  0  0
   -7.3200   -2.5600    0.5200 C   0  0  0
   -4.4800   -0.6400   -0.7000 N   0  0  0
   -5.2800   -1.0200    1.7000 C   0  0  0
   -7.2600   -2.4200    1.9200 C   0  0  0
   -3.3600    0.1400   -0.6000 C   0  0  0
   -6.2400   -1.6600    2.5000 C   0  0  0
   -2.4400    0.1600    0.5400 C   0  0  0
   -3.0800    0.9200   -1.5000 O   0  0  0
   -0.9600   -0.1600    0.1800 C   0  0  0
   -0.4000    0.7400   -0.9800 C   0  0  0
   -0.0400   -0.1000    1.4600 C   0  0  0
    1.1600    0.7000   -1.0600 C   0  0  3
    1.4800   -0.0400    1.1000 C   0  0  3
    1.6800    1.1600    0.2600 N   0  0  0
    1.7400   -0.7200   -1.2400 C   0  0  0
    1.9600   -1.2200    0.2000 C   0  0  0
    3.0600    1.7000    0.2400 C   0  0  0
  3  8  1
  6  9  2
  7 10  1
  8 11  1
  9 12  1
 11 13  1
 11 14  2
 13 15  1
 15 16  1
 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
  4  5  1
  6  8  1
 10 12  2
 19 20  1
 21 22  1
  1  2  1
  1  3  1
  1  4  1
  1  5  1
  2  6  1
  2  7  2
M  END
$$$$
tpls\mol-247.tpl
XXCombChem10310515113D                 0.00000

 25 29999 V2000
   -6.1000    2.2400   -2.0200 C   0  0  0
   -5.0600    3.1800   -1.5200 C   0  0  0
   -5.4600    0.8800   -1.6400 C   0  0  0
   -6.4400    2.3800   -3.5200 C   0  0  0
   -7.5000    2.4600   -1.3600 C   0  0  0
   -3.9800    2.5000   -0.9600 C   0  0  0
   -5.1000    4.5800   -1.6000 C   0  0  0
   -4.1800    1.1200   -1.0200 N   0  0  0
   -7.8200    1.7000   -3.7000 C   0  0  0
   -8.5000    1.7400   -2.3200 C   0  0  0
   -2.9000    3.2600   -0.4600 C   0  0  0
   -4.0200    5.3200   -1.0800 C   0  0  0
   -3.3800    0.1000   -0.5800 C   0  0  0
   -2.9200    4.6600   -0.5200 C   0  0  0
   -2.4400    0.1600    0.5400 C   0  0  0
   -3.4200   -0.9800   -1.1600 O   0  0  0
   -0.9600   -0.1600    0.1800 C   0  0  0
   -0.4000    0.7400   -0.9800 C   0  0  0
   -0.0400   -0.1000    1.4600 C   0  0  0
    1.1600    0.7000   -1.0600 C   0  0  3
    1.4800   -0.0400    1.1000 C   0  0  3
    1.6800    1.1600    0.2600 N   0  0  0
    1.7400   -0.7200   -1.2400 C   0  0  0
    1.9600   -1.2200    0.2000 C   0  0  0
    3.0600    1.7000    0.2400 C   0  0  0
  3  8  1
  4  9  1
  5 10  1
  6 11  2
  7 12  1
  8 13  1
 11 14  1
 13 15  1
 13 16  2
 15 17  1
 17 18  1
 17 19  1
 18 20  1
 19 21  1
 20 22  1
 20 23  1
 21 24  1
 22 25  1
  6  8  1
  9 10  1
 12 14  2
 21 22  1
 23 24  1
  1  2  1
  1  3  1
  1  4  1
  1  5  1
  2  6  1
  2  7  2
M  END
$$$$
tpls\mol-248.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -4.7400   -1.9000   -0.2000 C   0  0  0
   -4.4800   -0.6400   -0.7000 N   0  0  0
   -6.0200   -2.3400   -0.5600 C   0  0  0
   -3.9400   -2.7600    0.6000 C   0  0  0
   -5.6400   -0.2000   -1.4600 C   0  0  0
   -3.3600    0.1400   -0.6000 C   0  0  0
   -6.7200   -1.3400   -1.3800 C   0  0  0
   -6.5200   -3.6000   -0.1600 C   0  0  0
   -4.4400   -4.0200    1.0200 C   0  0  0
   -2.4400    0.1600    0.5400 C   0  0  0
   -3.0800    0.9200   -1.5000 O   0  0  0
   -8.0200   -0.8800   -0.7000 C   0  0  0
   -7.1000   -1.9200   -2.7600 C   0  0  0
   -5.7200   -4.4400    0.6400 C   0  0  0
   -0.9600   -0.1600    0.1800 C   0  0  0
   -0.4000    0.7400   -0.9800 C   0  0  0
   -0.0400   -0.1000    1.4600 C   0  0  0
    1.1600    0.7000   -1.0600 C   0  0  3
    1.4800   -0.0400    1.1000 C   0  0  3
    1.6800    1.1600    0.2600 N   0  0  0
    1.7400   -0.7200   -1.2400 C   0  0  0
    1.9600   -1.2200    0.2000 C   0  0  0
    3.0600    1.7000    0.2400 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  7 13  1
  8 14  1
 10 15  1
 15 16  1
 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 14  2
 19 20  1
 21 22  1
M  END
$$$$
tpls\mol-249.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -3.9000    2.9000    2.5000 C   0  0  0
   -3.5600    1.7000    1.9000 N   0  0  0
   -4.6200    2.6600    3.6800 C   0  0  0
   -3.6600    4.2400    2.1200 C   0  0  0
   -4.0600    0.6200    2.7200 C   0  0  0
   -2.8600    1.4800    0.7400 C   0  0  0
   -4.7800    1.2200    3.9400 C   0  0  0
   -5.1000    3.7200    4.5000 C   0  0  0
   -4.1400    5.3000    2.9200 C   0  0  0
   -2.5200    0.1600    0.2000 C   0  0  0
   -2.4600    2.4200    0.0800 O   0  0  0
   -4.1400    0.8400    5.3000 C   0  0  0
   -6.2800    0.8400    4.0200 C   0  0  0
   -4.8400    5.0600    4.1000 C   0  0  0
   -1.0000   -0.1400    0.0800 C   0  0  0
   -0.2800    0.7600   -1.0000 C   0  0  0
   -0.3000   -0.0600    1.4800 C   0  0  0
    1.2800    0.8000   -0.8000 C   0  0  3
    1.2600    0.0800    1.3800 C   0  0  3
    1.6600    1.2600    0.5600 N   0  3  0
    1.9000   -0.6200   -0.8600 C   0  0  0
    1.9000   -1.1000    0.6000 C   0  0  0
    1.1400    2.5800    1.0000 C   0  0  0
    3.0200    1.4800    0.6400 O   0  5  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  7 12  1
  7 13  1
  8 14  1
 10 15  1
 15 16  1
 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
 20 24  1
  5  7  1
  9 14  2
 19 20  1
 21 22  1
M  END
$$$$
tpls\mol-25.tpl
XXCombChem10310515113D                 0.00000

 23 25999 V2000
   -0.9200   -0.0800    0.2800 C   0  0  0
    0.4000   -0.2400   -0.1800 C   0  0  0
   -1.0000    1.2800    0.5800 C   0  0  0
   -1.9600   -1.0000    0.4200 C   0  0  0
    1.0400    1.0000   -0.1200 C   0  0  0
    1.1200   -1.3600   -0.6400 C   0  0  0
    0.1600    1.9000    0.3400 N   0  0  0
   -3.3600   -0.7800    0.9200 C   0  0  0
   -1.7400   -2.1800    0.1200 O   0  0  0
    2.3800    1.1600   -0.5200 C   0  0  0
    2.4800   -1.2200   -1.0400 C   0  0  0
    0.3800    3.3000    0.5600 C   0  0  0
   -4.2200   -2.1000    0.9200 C   0  0  0
   -3.4600   -0.1200    2.3200 C   0  0  0
   -4.0200    0.2800    0.0200 C   0  0  0
    3.1000    0.0400   -0.9800 C   0  0  0
   -4.3200   -2.8000   -0.3800 C   0  0  0
   -5.2800   -2.6400   -1.3600 C   0  0  0
   -3.4200   -3.6800   -0.8200 N   0  0  0
   -4.9600   -3.4600   -2.3600 N   0  0  0
   -6.4600   -1.7600   -1.3600 C   0  0  0
   -3.8200   -4.1000   -2.0200 C   0  0  0
   -5.4400   -3.6000   -3.2000 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  4  8  1
  4  9  2
  5 10  2
  6 11  1
  7 12  1
  8 13  1
  8 14  1
  8 15  1
 10 16  1
 13 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  5  7  1
 11 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-250.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -0.0200   -0.1600    0.1400 C   0  0  0
   -1.4000    0.2400   -0.0400 C   0  0  0
    0.2800   -1.5600    0.3000 C   0  0  0
    1.1200    0.7000    0.2000 C   0  0  0
   -2.4200   -0.7800   -0.0600 C   0  0  0
   -1.8600    1.5800   -0.2200 C   0  0  0
   -0.7600   -2.5200    0.2800 C   0  0  0
    1.5800   -2.0000    0.4800 C   0  0  0
    2.4000    0.2200    0.3600 N   0  0  0
    1.0000    1.9200    0.0800 O   0  0  0
   -2.0800   -2.1400    0.1000 C   0  0  0
   -3.7800   -0.4400   -0.2400 C   0  0  0
   -3.2000    1.9000   -0.4000 C   0  0  0
    2.6000   -1.1200    0.5000 C   0  0  0
    3.5600    1.1000    0.4200 C   0  0  0
   -4.1800    0.8800   -0.4000 C   0  0  0
    3.7200    1.8800   -0.8400 C   0  0  0
    4.7000    2.8000   -1.1600 C   0  0  0
    2.8800    1.7800   -1.8800 N   0  0  0
    4.4400    3.2400   -2.4000 N   0  0  0
    5.8400    3.2400   -0.3400 C   0  0  0
    3.3400    2.6200   -2.8400 C   0  0  0
    4.9400    3.9000   -2.9000 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  2
  9 15  1
 12 16  1
 15 17  1
 17 18  2
 17 19  1
 18 20  1
 18 21  1
 19 22  2
  7 11  2
  9 14  1
 13 16  2
 20 22  1
 20 23  1
M  END
$$$$
tpls\mol-251.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -0.0400   -0.1800   -0.0600 C   0  0  0
   -0.2800    1.1200   -0.6000 C   0  0  0
    1.3200   -0.5600    0.2600 C   0  0  0
   -1.2000   -1.0000    0.1000 C   0  0  0
    0.7800    2.0400   -0.8000 C   0  0  0
   -1.5800    1.5000   -0.9200 C   0  0  0
    2.3800    0.4000    0.0600 C   0  0  0
    1.7400   -1.8200    0.7800 C   0  0  0
   -2.4600   -0.5800   -0.2400 N   0  0  0
   -1.1200   -2.1400    0.5600 O   0  0  0
    2.1000    1.6600   -0.4600 C   0  0  0
    0.5200    3.2000   -1.2800 O   0  0  0
   -2.6200    0.6600   -0.7400 C   0  0  0
    3.7200    0.0800    0.3600 C   0  0  0
    3.0800   -2.1200    1.0800 C   0  0  0
   -3.6400   -1.4200   -0.0800 C   0  0  0
    1.2400    4.2800   -1.5800 C   0  0  0
    4.0800   -1.1600    0.8800 C   0  0  0
   -3.5200   -2.6800   -0.8800 C   0  0  0
   -4.4600   -3.7200   -0.9800 C   0  0  0
   -2.4800   -3.0000   -1.6400 N   0  0  0
   -3.9200   -4.6200   -1.8000 N   0  0  0
   -5.7600   -3.8200   -0.3200 C   0  0  0
   -2.7200   -4.1800   -2.2000 C   0  0  0
   -4.3400   -5.4600   -2.0800 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  1
  6 13  2
  7 14  1
  8 15  2
  9 16  1
 12 17  1
 14 18  2
 16 19  1
 19 20  2
 19 21  1
 20 22  1
 20 23  1
 21 24  2
  7 11  2
  9 13  1
 15 18  1
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-252.tpl
XXCombChem10310515113D                 0.00000

 27 30999 V2000
    0.4200    0.2200   -0.0600 C   0  0  0
   -0.9400    0.5800    0.3200 C   0  0  0
    0.6000   -0.9600   -0.8600 C   0  0  0
    1.6000    0.9200    0.2800 C   0  0  0
   -2.0200   -0.3000    0.0000 C   0  0  0
   -1.2800    1.7800    1.0000 C   0  0  0
   -0.4800   -1.8000   -1.2200 C   0  0  0
    1.9000   -1.2800   -1.3200 C   0  0  0
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   -3.3600    0.0000    0.4000 C   0  0  0
   -1.7600   -1.4600   -0.7600 C   0  0  0
   -2.5800    2.0800    1.4000 C   0  0  0
   -0.2800   -2.8400   -1.9200 O   0  0  0
    2.9600   -0.5400   -0.9800 C   0  0  0
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   -3.6200    1.1800    1.1200 C   0  0  0
   -4.3000   -0.8400    0.1400 O   0  0  0
   -1.0400   -3.8200   -2.4000 C   0  0  0
    4.3400    2.3800   -0.8400 C   0  0  0
   -5.6200   -0.8800    0.3600 C   0  0  0
    4.5600    2.2600   -2.2000 C   0  0  0
    4.4200    3.6600   -0.5000 N   0  0  0
    4.7600    3.5000   -2.6600 N   0  0  0
    4.5600    1.0200   -3.0000 C   0  0  0
    4.6800    4.3400   -1.6400 C   0  0  0
    4.9400    3.7400   -3.5800 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  5 12  1
  6 13  1
  7 14  1
  8 15  2
  9 16  1
 11 17  1
 11 18  1
 14 19  1
 16 20  1
 18 21  1
 20 22  2
 20 23  1
 22 24  1
 22 25  1
 23 26  2
  7 12  2
  9 15  1
 13 17  2
 24 26  1
 24 27  1
M  END
$$$$
tpls\mol-253.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -0.4400   -0.2600   -0.1200 C   0  0  0
    0.9400    0.1800   -0.0600 C   0  0  0
   -0.7200   -1.6400    0.1200 C   0  0  0
   -1.5800    0.5600   -0.4000 C   0  0  0
    1.9800   -0.7800    0.2200 C   0  0  0
    1.3800    1.5200   -0.2400 C   0  0  0
    0.3200   -2.5600    0.3800 C   0  0  0
   -2.0200   -2.1200    0.0800 C   0  0  0
   -2.8600    0.0400   -0.4200 N   0  0  0
   -1.4600    1.7400   -0.6200 O   0  0  0
    3.3400   -0.4000    0.2800 C   0  0  0
    1.6400   -2.1400    0.4200 C   0  0  0
    2.7400    1.8800   -0.1800 C   0  0  0
   -3.0400   -1.2800   -0.1800 C   0  0  0
   -4.0200    0.8600   -0.7000 C   0  0  0
    3.7400    0.9200    0.0800 C   0  0  0
   -4.3400    0.9200   -2.1400 C   0  0  0
    4.9400    1.3400    0.1200 O   0  0  0
   -4.6600   -0.1200   -3.0000 C   0  0  0
   -4.3400    2.0600   -2.8400 N   0  0  0
    5.5400    2.5400   -0.0400 C   0  0  0
   -4.8600    0.4200   -4.2000 N   0  0  0
   -4.7800   -1.5400   -2.6800 C   0  0  0
   -4.6800    1.7400   -4.1200 C   0  0  0
   -5.1000   -0.0600   -5.0200 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  2
  5 12  1
  6 13  1
  8 14  2
  9 15  1
 11 16  1
 15 17  1
 16 18  1
 17 19  2
 17 20  1
 18 21  1
 19 22  1
 19 23  1
 20 24  2
  7 12  2
  9 14  1
 13 16  2
 22 24  1
 22 25  1
M  END
$$$$
tpls\mol-254.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.0600    0.1600   -0.0600 C   0  0  0
    1.1800   -0.7200   -0.2000 C   0  0  0
    0.3200    1.5800   -0.0800 C   0  0  0
   -1.3200   -0.1800    0.0800 C   0  0  0
    2.5000   -0.2000   -0.4200 C   0  0  0
    1.0800   -2.1400   -0.1000 C   0  0  0
    1.6200    2.0800   -0.2800 C   0  0  0
   -0.7200    2.5000    0.0800 C   0  0  0
   -2.3000    0.7600    0.2400 N   0  0  0
   -1.6800   -1.3400    0.0400 O   0  0  0
    2.7000    1.2000   -0.4600 C   0  0  0
    3.6000   -1.0800   -0.5800 C   0  0  0
    2.1800   -3.0000   -0.2600 C   0  0  0
   -1.9800    2.0800    0.2400 C   0  0  0
   -3.7000    0.4000    0.4200 C   0  0  0
    4.0200    1.8400   -0.6800 C   0  0  0
    3.4400   -2.4800   -0.5200 C   0  0  0
   -4.4200    0.3000   -0.8800 C   0  0  0
   -4.6000    1.2800   -1.8400 C   0  0  0
   -5.0200   -0.8200   -1.3200 N   0  0  0
   -5.3000    0.7400   -2.8400 N   0  0  0
   -4.1200    2.6800   -1.8000 C   0  0  0
   -5.5400   -0.5400   -2.5200 C   0  0  0
   -5.5800    1.1800   -3.6600 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  2
  9 15  1
 11 16  1
 12 17  1
 15 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  7 11  2
  9 14  1
 13 17  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-255.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.0200    0.1800   -0.2000 C   0  0  0
    1.4000   -0.0800    0.1000 C   0  0  0
   -0.4000    1.5000   -0.5600 C   0  0  0
   -1.0400   -0.8000   -0.1800 C   0  0  0
    2.3400    0.9800   -0.0600 C   0  0  0
    1.9400   -1.3200    0.5800 C   0  0  0
    0.5800    2.5400   -0.7000 C   0  0  0
   -1.7400    1.7800   -0.8200 C   0  0  0
   -2.3400   -0.4800   -0.4200 N   0  0  0
   -0.8000   -1.9800    0.0400 O   0  0  0
    1.9200    2.2600   -0.4600 C   0  0  0
    3.7400    0.7800    0.1800 C   0  0  0
    3.3000   -1.5000    0.8200 C   0  0  0
    0.2600    3.9400   -1.1000 C   0  0  0
   -2.6800    0.8000   -0.7200 C   0  0  0
   -3.4200   -1.4600   -0.3600 C   0  0  0
    4.2000   -0.4600    0.6200 C   0  0  0
   -3.6400   -2.1200   -1.6800 C   0  0  0
   -3.9800   -1.5200   -2.8800 C   0  0  0
   -3.5200   -3.4400   -1.8800 N   0  0  0
   -4.0600   -2.5200   -3.8000 N   0  0  0
   -4.2200   -0.1000   -3.1600 C   0  0  0
   -3.7800   -3.6600   -3.1800 C   0  0  0
   -4.3000   -2.4200   -4.7400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  7 14  1
  8 15  2
  9 16  1
 12 17  1
 16 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  7 11  2
  9 15  1
 13 17  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-256.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
    0.0800    0.1600   -0.1600 C   0  0  0
   -1.2200   -0.0400   -0.7400 C   0  0  0
    0.5800    1.5200   -0.0200 C   0  0  0
    0.9600   -0.8400    0.3400 C   0  0  0
   -1.9600    1.1000   -1.2000 C   0  0  0
   -1.8600   -1.3000   -0.9000 C   0  0  0
   -0.2000    2.6000   -0.5000 C   0  0  0
    1.8200    1.7600    0.5600 C   0  0  0
    2.1800   -0.5400    0.9000 N   0  0  0
    0.6600   -2.0200    0.2600 O   0  0  0
   -1.4400    2.4000   -1.0800 C   0  0  0
   -3.2400    0.9600   -1.8000 C   0  0  0
   -3.1400   -1.4400   -1.5000 C   0  0  0
    0.2000    3.8000   -0.4000 O   0  0  0
    2.5800    0.7400    1.0000 C   0  0  0
    3.0600   -1.6000    1.4000 C   0  0  0
   -3.8200   -0.3000   -1.9600 C   0  0  0
    2.8200   -1.9000    2.8400 C   0  0  0
    2.8800   -1.0400    3.9400 C   0  0  0
    2.4400   -3.1000    3.2800 N   0  0  0
    2.5600   -1.7600    5.0200 N   0  0  0
    3.2400    0.4000    3.9400 C   0  0  0
    2.3000   -3.0000    4.6200 C   0  0  0
    2.5200   -1.4400    5.9400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  7 14  1
  8 15  2
  9 16  1
 12 17  1
 16 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  7 11  2
  9 15  1
 13 17  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-257.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -0.0200    0.1800   -0.1200 C   0  0  0
    1.3200   -0.2800   -0.4000 C   0  0  0
   -0.2800    1.5800   -0.1200 C   0  0  0
   -1.1800   -0.6400    0.1200 C   0  0  0
    2.3400    0.7000   -0.6800 C   0  0  0
    1.7200   -1.6400   -0.4000 C   0  0  0
    0.7400    2.5000   -0.4000 C   0  0  0
   -1.5600    2.0800    0.1400 C   0  0  0
   -2.4200   -0.1000    0.4000 N   0  0  0
   -1.1000   -1.8600    0.1200 O   0  0  0
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    3.6800    0.2800   -0.9600 C   0  0  0
    3.0400   -2.0400   -0.6800 C   0  0  0
   -2.5800    1.2400    0.4000 C   0  0  0
   -3.5800   -0.9400    0.6800 C   0  0  0
    3.2800    3.4400   -1.0200 Br  0  0  0
    4.0200   -1.0800   -0.9600 C   0  0  0
   -3.8800   -1.8600   -0.4600 C   0  0  0
   -4.9200   -2.7800   -0.5600 C   0  0  0
   -3.1800   -1.9000   -1.6000 N   0  0  0
   -4.8000   -3.3600   -1.7600 N   0  0  0
   -5.9600   -3.0800    0.4400 C   0  0  0
   -3.7400   -2.8200   -2.3800 C   0  0  0
   -5.3800   -4.0600   -2.1200 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  4 10  2
  5 11  1
  5 12  2
  6 13  1
  8 14  2
  9 15  1
 11 16  1
 12 17  1
 15 18  1
 18 19  2
 18 20  1
 19 21  1
 19 22  1
 20 23  2
  7 11  2
  9 14  1
 13 17  2
 21 23  1
 21 24  1
M  END
$$$$
tpls\mol-258.tpl
XXCombChem10310515113D                 0.00000

 24 27  0  0  1  0999 V2000
   -4.7400   -1.8600    0.3200 C   0  0  0
   -4.5800   -0.7200   -0.5200 C   0  0  0
   -5.9400   -2.6200    0.4000 C   0  0  0
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   -7.2000   -4.5200    1.4000 C   0  0  0
   -0.8800    0.3800   -0.5400 C   0  0  2
   -8.2400   -0.6200   -2.2200 Cl  0  0  0
    0.3400   -0.4400   -1.1000 C   0  0  0
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    0.8200   -1.4800   -0.0400 C   0  0  0
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    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
   -1.0800    1.1800   -1.2400 H   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  8 14  1
 15 10  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
  9 13  1
 21 22  1
 21 23  1
 15 24  1
M  END
$$$$
tpls\mol-26.tpl
XXCombChem10310515113D                 0.00000

 26 29  0  0  1  0999 V2000
    4.7700    6.8500    8.1530 C   0  0  0
    6.1240    6.9790    7.9810 N   0  0  0
    4.4260    6.9760    9.5120 C   0  0  0
    3.7260    6.6210    7.2230 C   0  0  0
    6.7070    7.2110    9.2720 C   0  0  0
    6.8650    6.9090    6.8400 C   0  0  0
    5.6030    7.2060   10.3710 C   0  0  0
    3.0830    6.8770    9.9410 C   0  0  0
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    5.4980    8.5700   11.1190 C   0  0  0
    5.7830    6.0440   11.3950 C   0  0  0
    2.0630    6.6500    9.0010 C   0  0  0
    9.0500    6.9510    5.5600 C   0  0  1
   10.4910    7.5430    5.7280 C   0  0  0
    9.1180    5.4890    5.0070 C   0  0  0
   11.5650    6.5120    6.2000 C   0  0  2
   10.3130    4.6540    5.5650 C   0  0  1
   11.6030    5.3330    5.3040 N   0  0  0
   11.2760    5.7640    7.5220 C   0  0  0
   10.4020    4.5570    7.1070 C   0  0  0
   12.1830    5.4100    3.9440 C   0  0  0
    8.5650    7.5830    4.8070 H   0  0  0
   12.5400    7.0050    6.2590 H   0  0  0
   10.2950    3.6510    5.1250 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  1
  3  7  1
  3  8  2
  4  9  1
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  6 11  2
  7 12  1
  7 13  1
  8 14  1
 15 10  1
 15 16  1
 15 17  1
 16 18  1
 17 19  1
 18 20  1
 18 21  1
 19 22  1
 20 23  1
  5  7  1
  9 14  2
 19 20  1
 21 22  1
 15 24  1
 18 25  1
 19 26  1
M  END
$$$$
tpls\mol-260.tpl
XXCombChem10310515113D                 0.00000

 22 25999 V2000
   -5.8800   -0.1800   -0.7200 C   0  0  0
   -4.5800   -0.7200   -0.5200 C   0  0  0
   -7.0400   -1.0000   -0.6200 C   0  0  0
   -6.0600    1.0400   -1.0000 O   0  0  0
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   -4.5000   -2.1200   -0.2200 C   0  0  0
   -6.9200   -2.3600   -0.3200 C   0  0  0
   -8.2800   -0.4400   -0.8000 N   0  0  0
   -7.1800    1.7600   -1.2200 C   0  0  0
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   -5.6400   -2.9200   -0.1200 C   0  0  0
   -8.5000    0.9400   -1.1200 C   0  0  0
   -0.8800    0.3800   -0.5400 C   0  0  3
   -5.5000   -4.5800    0.2600 Cl  0  0  0
    0.3400   -0.4400   -1.1000 C   0  0  0
   -0.4400    1.0200    0.8400 C   0  0  0
    0.8200   -1.4800   -0.0400 C   0  0  0
    1.5200    0.5600   -1.3400 C   0  0  0
    1.0000    0.7600    1.1400 N   0  0  0
    1.2200   -0.7200    1.2800 C   0  0  0
    1.8600    1.2800    0.0000 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
 10 14  1
 12 15  1
 14 16  1
 14 17  1
 16 18  1
 16 19  1
 17 20  1
 18 21  1
 19 22  1
  7 12  2
  9 13  1
 20 21  1
 20 22  1
M  END
$$$$
tpls\mol-261.tpl
XXCombChem10310515113D                 0.00000

 25 28999 V2000
   -6.0800   -0.8600    2.5200 C   0  0  0
   -4.9000   -0.6800    1.7400 C   0  0  0
   -6.8200    0.3000    2.9000 N   0  0  0
   -6.4400   -2.1600    2.8800 C   0  0  0
   -4.1000   -1.7800    1.2800 C   0  0  0
   -4.5600    0.5200    1.4200 O   0  0  0
   -6.0400    1.5200    2.9800 C   0  0  0
   -8.1600    0.3000    3.2200 C   0  0  0
   -5.7000   -3.2800    2.4600 C   0  0  0
   -2.9200   -1.6600    0.5000 C   0  0  0
   -4.5600   -3.0800    1.6800 C   0  0  0
   -5.1400    1.6800    1.7400 C   0  0  0
   -9.1400   -0.5600    2.6200 C   0  0  0
   -8.6200    1.1000    4.0200 O   0  0  0
   -6.1600   -4.8400    2.9200 Cl  0  0  0
   -2.0600   -0.6200    0.5000 N   0  0  0
   -2.6400   -2.5600   -0.2800 O   0  0  0
   -0.8600   -0.4600   -0.3000 C   0  0  3
    0.4200   -1.1200    0.3400 C   0  0  0
   -0.5000    1.0400   -0.6200 C   0  0  0
    1.5800   -1.0600   -0.7200 C   0  0  0
    0.8800   -0.2800    1.5800 C   0  0  0
    0.9400    1.3600   -0.3400 N   0  0  0
    1.8200    0.4400   -1.1200 C   0  0  0
    1.2000    1.1800    1.1400 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  1
  6 12  1
  8 13  1
  8 14  2
  9 15  1
 10 16  1
 10 17  2
 16 18  1
 18 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
 22 25  1
  7 12  1
  9 11  2
 23 24  1
 23 25  1
M  END
$$$$
tpls\mol-262.tpl
XXCombChem10310515113D                 0.00000

 23 26999 V2000
   -4.6600   -0.3400   -2.1600 C   0  0  0
   -4.5000   -0.9200   -0.8600 C   0  0  0
   -5.8400   -0.5200   -2.9400 C   0  0  0
   -3.7200    0.3200   -2.6800 O   0  0  0
   -3.3200   -0.7600   -0.0600 C   0  0  0
   -5.6000   -1.6600   -0.3600 C   0  0  0
   -6.9000   -1.2800   -2.3800 C   0  0  0
   -5.9200    0.0800   -4.2000 N   0  0  0
   -3.5800    0.9600   -3.8600 C   0  0  0
   -2.0600   -0.6200   -0.5000 N   0  0  0
   -3.4600   -0.7600    1.1600 O   0  0  0
   -6.7800   -1.8400   -1.1000 C   0  0  0
   -4.8400    0.8600   -4.7600 C   0  0  0
   -7.0800   -0.0400   -5.0400 C   0  0  0
   -0.8600   -0.4600    0.3000 C   0  0  3
   -7.7600   -2.5400   -0.6000 F   0  0  0
    0.4200   -1.1200   -0.3400 C   0  0  0
   -0.5000    1.0400    0.6200 C   0  0  0
    1.5800   -1.0600    0.7200 C   0  0  0
    0.8800   -0.2800   -1.5800 C   0  0  0
    0.9400    1.3600    0.3400 N   0  0  0
    1.8200    0.4400    1.1200 C   0  0  0
    1.2000    1.1800   -1.1400 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  8 14  1
 10 15  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 17 20  1
 18 21  1
 19 22  1
 20 23  1
  7 12  2
  9 13  1
 21 22  1
 21 23  1
M  END
$$$$
tpls\mol-263.tpl
XXCombChem10310515113D                 0.00000

 24 27999 V2000
   -5.2400   -2.1200   -0.3800 C   0  0  0
   -4.6400   -1.8600    0.9000 C   0  0  0
   -6.6000   -2.5400   -0.5200 C   0  0  0
   -4.5400   -2.0200   -1.4400 O   0  0  0
   -3.2800   -1.4400    1.0800 C   0  0  0
   -5.4800   -2.0000    2.0400 C   0  0  0
   -7.3800   -2.6600    0.6600 C   0  0  0
   -7.1000   -2.7800   -1.7800 N   0  0  0
   -4.8400   -2.2200   -2.7200 C   0  0  0
   -2.5200   -0.7200    0.2000 N   0  0  0
   -2.7200   -1.7600    2.1200 O   0  0  0
   -6.8200   -2.4000    1.9200 C   0  0  0
   -6.3000   -2.6400   -2.9800 C   0  0  0
   -8.4600   -3.1800   -2.0200 C   0  0  0
   -1.1600   -0.3000    0.3600 C   0  0  0
   -7.7800   -2.5600    3.3200 Cl  0  0  0
   -0.1600   -1.4200   -0.0800 C   0  0  0
   -0.9000    1.0400   -0.4200 C   0  0  0
    1.2800   -0.8800   -0.3600 C   0  0  3
    0.6200    1.3200   -0.6400 C   0  0  3
    1.1400    0.1600   -1.4200 N   0  0  0
    1.9000   -0.1400    0.8600 C   0  0  0
    1.4600    1.3400    0.6600 C   0  0  0
    2.3800    0.4200   -2.1800 C   0  0  0
  1  2  1
  1  3  2
  1  4  1
  2  5  1
  2  6  2
  3  7  1
  3  8  1
  4  9  1
  5 10  1
  5 11  2
  6 12  1
  8 13  1
  8 14  1
 10 15  1
 12 16  1
 15 17  1
 15 18  1
 17 19  1
 18 20  1
 19 21  1
 19 22  1
 20 23  1
 21 24  1
  7 12  2
  9 13  1
 20 21  1
 22 23  1
M  END
$$$$
tpls\mol-264.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -2.5200    3.4600    1.0200 C   0  0  0
   -1.7000    2.3600    0.9600 C   0  0  0
   -1.7600    4.4400    1.6800 C   0  0  0
   -3.8400    3.7800    0.6200 C   0  0  0
   -1.9400    1.0600    0.3800 C   0  0  0
   -0.5400    2.6800    1.5400 N   0  0  0
   -0.5800    3.9000    1.9600 N   0  0  0
   -2.2600    5.7200    1.9400 C   0  0  0
   -4.3600    5.0600    0.8800 C   0  0  0
   -1.1200   -0.0400    0.3000 N   0  0  0
   -3.0600    0.9400   -0.1200 O   0  0  0
   -3.5800    6.0200    1.5400 C   0  0  0
   -0.1000   -0.3400    1.3000 C   0  0  0
   -1.2000   -1.0200   -0.7800 C   0  0  0
    1.3400   -0.4200    0.6800 C   0  0  3
    0.1600   -1.1000   -1.5400 C   0  0  0
    1.3400   -1.3400   -0.5800 C   0  0  0
    2.0200    0.9000    0.4400 N   0  0  0
    2.1800    1.7800    1.6200 C   0  0  0
    1.4200    1.7200   -0.6200 C   0  0  0
    0.1600    4.3400    2.4200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  8 12  1
 10 13  1
 10 14  1
 13 15  1
 14 16  1
 15 17  1
 15 18  1
 18 19  1
 18 20  1
  6  7  1
  9 12  2
 16 17  1
  7 21  1
M  END
$$$$
tpls\mol-265.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -4.2600    0.2400   -0.2200 C   0  0  0
   -3.2600    1.2000   -0.0800 C   0  0  0
   -5.4000    0.8800   -0.7400 C   0  0  0
   -4.3400   -1.1600    0.0200 C   0  0  0
   -1.9400    1.0600    0.3800 C   0  0  0
   -3.8400    2.4000   -0.5200 C   0  0  0
   -5.1200    2.1800   -0.9000 N   0  0  0
   -6.6000    0.2000   -1.0000 C   0  0  0
   -5.5200   -1.8600   -0.2400 C   0  0  0
   -1.1200   -0.0400    0.3000 N   0  0  0
   -1.4600    2.0600    0.9400 O   0  0  0
   -6.6600   -1.1800   -0.7600 C   0  0  0
   -0.1000   -0.3400    1.3000 C   0  0  0
   -1.2000   -1.0200   -0.7800 C   0  0  0
    1.3400   -0.4200    0.6800 C   0  0  3
    0.1600   -1.1000   -1.5400 C   0  0  0
    1.3400   -1.3400   -0.5800 C   0  0  0
    2.0200    0.9000    0.4400 N   0  0  0
    3.3800    0.8600   -0.0800 C   0  0  0
    2.0400    1.8200    1.6000 C   0  0  0
   -5.7200    2.8600   -1.2400 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  8 12  1
 10 13  1
 10 14  1
 13 15  1
 14 16  1
 15 17  1
 15 18  1
 18 19  1
 18 20  1
  6  7  1
  9 12  2
 16 17  1
  7 21  1
M  END
$$$$
tpls\mol-266.tpl
XXCombChem10310515113D                 0.00000

 21 23999 V2000
   -4.2600    0.2400   -0.2400 C   0  0  0
   -3.2600    1.2000   -0.0800 C   0  0  0
   -5.4000    0.8800   -0.7400 C   0  0  0
   -4.3200   -1.1600    0.0200 C   0  0  0
   -1.9400    1.0600    0.3800 C   0  0  0
   -3.8400    2.4000   -0.5200 C   0  0  0
   -5.1200    2.2000   -0.9000 N   0  0  0
   -6.6000    0.1800   -1.0000 C   0  0  0
   -5.5200   -1.8600   -0.2400 C   0  0  0
   -1.1200   -0.0400    0.3000 N   0  0  0
   -1.4600    2.0600    0.9400 O   0  0  0
   -5.9800    3.2000   -1.4000 C   0  0  0
   -6.6400   -1.2000   -0.7600 C   0  0  0
   -0.1000   -0.3400    1.3000 C   0  0  0
   -1.2000   -1.0200   -0.7800 C   0  0  0
    1.3400   -0.4200    0.6800 C   0  0  3
    0.1600   -1.1000   -1.5400 C   0  0  0
    1.3400   -1.3400   -0.5800 C   0  0  0
    2.0200    0.9000    0.4400 N   0  0  0
    3.3800    0.8600   -0.0800 C   0  0  0
    2.0400    1.8200    1.6000 C   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  1
  2  6  2
  3  7  1
  3  8  2
  4  9  1
  5 10  1
  5 11  2
  7 12  1
  8 13  1
 10 14  1
 10 15  1
 14 16  1
 15 17  1
 16 18  1
 16 19  1
 19 20  1
 19 21  1
  6  7  1
  9 13  2
 17 18  1
M  END
$$$$
tpls\mol-267.tpl
XXCombChem10310515113D                 0.00000

 24 26  0  0  1  0999 V2000
    2.8200   -3.8600   -2.3400 C   0  0  0
    3.7800   -3.2200   -1.5600 C   0  0  0
    3.4200   -4.9800   -2.9400 C   0  0  0
    1.4400   -3.6200   -2.6000 C   0  0  0
    4.9400   -3.9800   -1.7400 C   0  0  0
    3.6800   -2.0600   -0.7600 C   0  0  0
    4.7000   -5.0200   -2.5400 N   0  0  0
    2.7200   -5.8600   -3.7800 C   0  0  0
    0.7200   -4.4800   -3.4600 C   0  0  0
    2.6000   -1.4400   -0.6800 O   0  0  0
    4.6600   -1.6400   -0.1400 O   0  0  0
    1.3600   -5.6000   -4.0400 C   0  0  0
    2.1600   -0.3400   -0.0400 C   0  0  1
    0.6400   -0.0800   -0.3400 C   0  0  2
    2.4200   -0.5400    1.4600 C   0  0  0
    0.1400    1.2200    0.2000 N   0  0  0
   -0.2800   -1.2600    0.1000 C   0  0  0
   -1.2800    1.5200   -0.2000 C   0  0  0
    0.3600    1.4600    1.6600 C   0  0  0
   -1.7600   -1.0000   -0.2800 C   0  0  0
   -2.2600    0.4000    0.2200 C   0  0  0
    0.5600    0.0000   -1.4400 H   0  0  0
    5.3600   -5.7000   -2.8200 H   0  0  0
    2.7200    0.5400   -0.3200 H   0  0  0
  1  2  1
  1  3  1
  1  4  2
  2  5  2
  2  6  1
  3  7  1
  3  8  2
  4  9  1
  6 10  1
  6 11  2
  8 12  1
 10 13  1
 13 14  1
 13 15  1
 14 16  1
 14 17  1
 16 18  1
 16 19  1
 17 20  1
 18 21  1
  5  7  1
  9 12  2
 20 21  1
 14 22  1
  7 23  1
 13 24  1
M  END
$$$$