IBS-ZINC02259435 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3780 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0040 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.6800 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0340 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4160 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0880 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.8230 -0.0240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.8100 -0.0590 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.0390 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -2.7070 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.1980 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -4.6440 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -5.0350 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -6.3680 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -6.9980 -0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -7.2050 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -8.5800 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -9.4290 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -10.7910 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -11.2600 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -10.3590 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -9.0640 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -13.3120 -0.5220 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9050 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5570 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9710 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.4240 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -2.4210 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -4.6780 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -6.8510 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -9.0300 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -11.4750 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -10.7180 -0.2610 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 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 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 M END