CHEMDIV-ZINC00095835 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.6780 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -4.0470 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -4.6090 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -3.7690 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -2.3920 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -4.6050 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -4.3290 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -5.8900 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -5.8900 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -7.3330 0.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -8.6140 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -9.9730 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 -10.0660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -11.0850 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -12.3390 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -13.4670 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -14.5660 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -14.3560 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -12.6160 -0.0030 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.2460 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -4.6850 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -1.7450 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -8.5040 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -8.5130 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -11.0100 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -15.5560 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -15.1200 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 M END