CHEMBRIDGE-ZINC00297141 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 0.2220 -0.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3610 -1.1100 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 -0.9740 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -2.2100 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -2.6640 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 -4.0170 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 -4.9290 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 -4.4940 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 -3.1360 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 -2.4140 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 -1.9570 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8270 -4.3700 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -5.9880 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 -5.2110 -0.0850 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 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 M END