IBS-ZINC03977785 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 0.0640 1.4130 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.0130 -0.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -0.5090 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 0.1760 0.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -2.0370 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8600 -2.3440 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.6550 -0.9770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5850 -2.2630 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -4.1820 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -4.6920 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -4.0900 -0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3750 -4.4320 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -2.5460 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2550 -2.1960 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -1.9860 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 -2.4940 -1.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4510 -2.2210 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -2.0050 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 -2.7610 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -1.9120 -4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -2.0970 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3510 -1.0100 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7950 0.2470 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8950 0.4570 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 -0.6410 -4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 -0.7200 -2.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 0.0690 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -4.2110 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 -4.6120 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -4.6070 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.3440 -0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.3680 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.6910 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.8850 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.7530 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.5850 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.5780 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -4.4610 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -5.7850 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -0.8910 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -2.2460 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4630 -3.0710 -5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0490 -1.1470 -6.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0640 1.0800 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 1.4380 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8610 -4.4550 -3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -4.7930 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -4.2360 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1990 -5.7010 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -5.6970 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -4.3210 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -4.0230 -1.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3390 -4.2760 -2.1530 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 28 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 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 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 52 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END