CHEMBRIDGE-ZINC00298129 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -0.9370 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.5880 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -1.9540 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -1.9100 -3.2360 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 -2.7520 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 -3.2180 -3.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -3.8030 -3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3980 -4.4510 -3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2910 -4.9490 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0470 -4.8120 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9070 -4.1740 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 -3.6660 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -3.0030 -1.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5930 -4.5610 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1870 -5.4510 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7540 -5.2060 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 -4.0710 0.2220 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 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 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 M END