IBS-ZINC02094287 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.3150 0.8780 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.4320 1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.9220 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.2730 1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -2.2460 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.9520 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -4.1890 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -4.7390 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -4.0550 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.8090 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.1190 0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -2.7960 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -3.9960 0.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -2.0630 0.4410 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1760 -1.2990 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -1.4210 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 -2.5130 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9160 -3.2810 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8600 -4.0340 -0.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -3.0050 0.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -3.5710 1.9570 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9170 -3.2700 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0240 -3.1110 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5750 -1.8720 2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9080 -1.7660 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6880 -2.9020 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1450 -4.1490 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -4.2640 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9490 -5.4270 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3180 -6.5840 2.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7030 -5.0220 1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 1.1530 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.6130 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 0.8510 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.5270 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -4.7320 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -5.7100 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -4.4900 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.1520 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 -0.4970 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -1.2450 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0490 -2.0600 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 -3.1680 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9690 -0.9840 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3400 -0.7930 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7270 -2.8120 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7570 -5.0340 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M END