IBS-ZINC02360587 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.3840 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0030 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6750 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4210 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0920 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -2.1120 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -2.6820 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -1.9410 -2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 0.0980 -0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6790 1.1700 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -0.3640 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 -0.2720 -2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -0.8760 -1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -0.9580 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 -1.4110 0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -0.2850 1.2390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9120 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5470 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7540 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 1.9740 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1710 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -2.4400 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -2.4620 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 -1.1980 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -4.0110 -1.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -4.3290 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 27 28 1 0 0 0 0 M END