IFLAB-ZINC04942035 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.3630 1.7960 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 0.3160 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.4640 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.8100 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.6270 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -3.9940 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.5510 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -3.7330 -2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -2.3670 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9380 -1.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -6.7700 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.3220 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -8.2550 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -9.0940 0.4620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -10.7660 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -11.3440 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -12.6550 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -13.3830 -0.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -12.8920 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -11.5640 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -11.0550 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -9.9120 -0.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -11.8900 -1.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -13.1530 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -13.8640 -2.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -13.6600 -1.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -15.0480 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -11.4100 -2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -10.5440 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.9440 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 2.1070 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 2.3910 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 0.0050 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.1680 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -2.1930 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.6290 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -4.1660 -3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.7310 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -6.3000 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -8.6190 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -8.4590 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -13.0990 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -15.7050 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -15.3250 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -15.1480 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -10.9800 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -12.2430 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -10.6510 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -10.6620 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -10.8980 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -9.4910 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END