CHEMBRIDGE-ZINC01110297 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.3210 2.1640 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 0.7930 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.0290 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 0.5180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.8920 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 2.7120 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 2.5080 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 1.4800 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 1.8960 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 0.9660 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 -0.3860 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -0.8060 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 0.1270 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -0.3050 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 3.1770 -1.6420 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 3.9990 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 4.6150 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 4.5100 -3.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 5.2840 -2.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 5.7580 -4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0530 6.9460 -4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4730 7.4180 -5.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 6.7020 -6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 5.5090 -6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0380 5.0410 -5.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6220 7.2040 -7.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 8.2410 -7.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 2.8080 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 0.3650 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -1.1000 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 3.7830 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 3.3190 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 2.9500 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 1.2940 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -1.1120 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -1.8620 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 4.7780 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 3.2680 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 5.4340 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2830 7.4980 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0330 8.3390 -5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 4.9540 -7.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 4.1180 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3340 6.5140 -9.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 6.8820 -9.8540 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 44 45 1 0 0 0 0 M END