COMGENEX-ZINC04158321 MOE2007 3D Structure written by MMmdl. 41 42 0 0 0 0 0 0 0 0999 V2000 -2.9630 -6.9850 8.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -7.4280 7.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -6.5000 6.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -6.9860 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -6.1440 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -4.8010 4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -4.3080 5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -5.1570 6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -3.9430 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -4.3040 2.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -2.6530 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -2.1060 2.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -0.5770 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 0.8310 3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.5740 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 0.6380 2.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 0.9460 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.1170 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 1.4370 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 1.6950 -0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 3.0390 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 3.7050 3.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -6.6310 9.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -6.2150 8.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -7.8420 9.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -8.0300 5.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -6.5480 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -3.2660 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -4.7380 7.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -2.8050 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -1.8820 3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 1.0820 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 1.8570 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 0.1470 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.2030 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 1.9140 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 3.4070 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 3.2480 4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 4.6610 3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -0.4810 3.6390 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8270 -1.2700 3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 16 1 0 0 0 0 13 40 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 3 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END