IFLAB-ZINC04036419 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.1050 1.6440 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.1160 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -0.3270 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -0.4370 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -1.2820 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -1.7920 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -1.4540 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -0.6000 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -0.1020 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -1.9940 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -3.1260 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0270 -3.7260 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0370 -3.2310 -0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0470 -4.8420 -1.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -5.3320 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -6.4120 -2.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -4.2110 -1.4980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 2.0440 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 1.9590 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 2.0170 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.2580 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 0.0460 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -1.4160 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 0.0730 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -1.5420 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -2.4500 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -0.3350 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 0.5540 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -1.4870 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -5.3040 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -6.6710 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 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 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 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 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 31 1 0 0 0 0 M END