IBS-ZINC02092904 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 1.0980 0.8090 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -0.6790 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.2560 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -2.6210 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -3.4100 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.8330 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.4670 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -5.1500 -0.4920 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -5.7270 -1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -5.5060 0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -5.4290 -0.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -5.1280 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -5.8060 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 -5.4960 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -4.8040 -3.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 -5.9900 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 -5.6010 -3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6120 -6.3940 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4230 -6.0170 -5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1550 -4.8280 -5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0330 -4.3990 -6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7170 -3.2350 -6.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5690 -2.4780 -5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1880 -1.4360 -5.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7630 -2.8770 -4.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0550 -4.0230 -4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -4.4240 -3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 -3.5780 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6320 -2.7530 -7.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1720 -5.2270 -7.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 1.0340 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 1.1560 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 1.3130 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.6400 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -3.0710 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -3.4490 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.0160 -3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -5.7920 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.0500 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -5.4990 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -6.8840 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -5.4350 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -7.3110 -4.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4990 -6.6350 -6.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -2.8570 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 -3.0470 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -4.2170 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6340 -3.1500 -7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 -1.6640 -7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2560 -3.0970 -8.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9870 -5.9400 -7.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3880 -4.5740 -8.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2430 -5.7660 -8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END