IBS-ZINC02107402 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 31 0 0 1 0 0 0 0 0999 V2000 0.4620 0.9560 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.3040 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.0620 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -0.7410 -0.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -2.0590 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.9800 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -2.2120 -1.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -1.4280 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -3.4830 -1.3620 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7240 -4.2710 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -3.8370 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -4.1670 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -4.7530 2.2470 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -5.0350 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 -3.3840 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -2.1930 -3.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 1.2780 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 0.7750 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.7810 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -1.1010 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 0.7140 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.9740 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.2530 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.0550 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -3.0040 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -4.7010 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -4.9490 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -3.2780 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -5.4040 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -5.7840 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -4.1030 3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -4.4820 -3.2280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 M CHG 1 32 -1 M END