IBS-ZINC02113506 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -2.0550 0.2210 2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.8040 1.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.0230 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.2690 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.4920 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -1.4690 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -2.2270 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0140 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.8300 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -4.2280 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -4.9770 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -4.3090 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -2.9220 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.2390 -0.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -2.1990 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -2.8150 -3.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -0.8560 -2.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -0.1390 -3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 1.3630 -3.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1380 1.5640 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 2.1320 -4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 3.4330 -4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 3.2960 -4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 1.8730 -3.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -6.3880 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -7.5840 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -8.7770 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -8.7910 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -7.6160 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -6.4000 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -5.0960 0.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -4.8320 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 1.1740 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 0.2920 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.0220 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.4950 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 0.0980 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -1.6370 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -2.9880 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.8590 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -0.3640 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.3340 -4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -0.4800 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 1.5580 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 2.3600 -4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 3.5020 -5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 4.3030 -4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 3.7100 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 3.7940 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -7.5760 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -9.7040 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -9.7310 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -7.6390 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 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 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 M END