IBS-ZINC04907768 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6720 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9290 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5310 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1060 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -2.6150 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -1.9190 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -2.5200 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 -1.8180 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -0.4530 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5950 0.1320 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7340 1.3370 0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 -0.8290 0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.3590 -0.7020 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9620 -2.4680 0.0730 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.6250 -0.6340 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8430 -1.5160 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0550 -0.9830 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1720 -1.7920 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0800 -3.1340 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8690 -3.6690 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7510 -2.8580 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2320 -3.5270 -1.8910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.5980 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7520 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.0470 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1850 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -3.6940 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6040 0.0870 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9350 0.4090 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0480 -0.9000 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1280 0.0660 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1190 -1.3750 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9530 -3.7660 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7970 -4.7180 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 M END