IBS-ZINC02239992 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.2260 -2.9330 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -3.0020 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -1.9860 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -2.3620 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -1.4190 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -1.7940 2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -0.8330 3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 0.4830 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 1.3360 3.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 0.8200 1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -0.0880 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 0.2770 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -0.6680 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.3090 -2.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -0.5510 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -0.9710 -3.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.2990 -4.8240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6600 -0.9160 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 1.1770 -4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 2.0470 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 1.5010 -3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -0.6390 -5.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -1.2980 -7.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -1.5410 -8.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.4860 -7.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.8760 -6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -4.0000 -6.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -5.2390 -6.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -5.3540 -6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -4.2300 -6.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.9920 -6.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -6.7040 -5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -3.2070 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -3.6680 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.9350 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -3.1470 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.7880 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -4.0000 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -3.3850 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -1.0750 4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 1.2960 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 1.3780 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 1.8460 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 3.0990 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 1.8160 -5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 1.3000 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 0.8820 -4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 2.5530 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -0.4780 -5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -3.9110 -7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -6.1170 -6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -4.3190 -6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -2.1140 -6.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -7.1730 -6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -6.5820 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -7.3330 -5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -3.3170 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -3.4300 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -3.8980 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 13 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END