PUBCHEM-ZINC06308260 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.8620 2.4240 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 1.0830 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.7640 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 0.4130 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 0.8300 4.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -0.5460 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -2.0000 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -2.9200 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -2.8790 4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -3.7650 4.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -5.1080 4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 -5.4300 4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 -4.3690 4.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -3.3040 4.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -6.7230 5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -7.8190 5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -7.4460 5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -6.0840 5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -5.8230 5.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -2.3440 2.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -3.7500 3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -4.5140 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.1700 0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -0.3210 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -0.4150 0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.0520 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.2130 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 3.2450 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 2.6680 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 2.4080 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.0800 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 1.6240 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -2.5840 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -3.9430 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -3.1680 5.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -1.8500 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1350 -6.7030 6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 -6.9310 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 -8.7620 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -7.9900 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -7.4120 6.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -8.2100 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -0.3020 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -3.7550 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -4.2820 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 0.2050 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.9850 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 2.0100 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 0.2820 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 1.4470 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -5.4270 1.6790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 51 -1 M END