IBS-ZINC02202482 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -1.0030 0.9270 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -0.5210 -1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.4260 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -1.1340 -2.6990 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.4680 -2.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -0.1500 -3.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -1.2370 -2.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -2.3970 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -2.1250 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -0.6580 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.1580 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 1.2160 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.0710 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 1.5760 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 0.2170 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -3.0980 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -4.4080 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 -5.4000 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -6.5830 -2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -5.0050 -2.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 -5.9990 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -5.2920 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2870 -4.4660 -2.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -4.8100 -1.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -5.6930 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -6.2180 -3.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -6.0220 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -6.8950 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -6.9010 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -6.0420 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -5.5190 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.3370 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 1.3890 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 1.1340 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.8450 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -2.0980 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.0100 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -3.3850 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.6130 -2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 3.1370 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 2.2570 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -0.1660 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -2.7730 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -4.0630 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6910 -6.5460 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3340 -6.6950 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 -6.0350 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -4.6740 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1150 -3.9860 -2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -4.4520 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -7.4690 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -7.4820 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -5.8180 -0.6080 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 2 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 24 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 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 M END