IBS-ZINC04363915 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -0.3320 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 -1.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -0.7120 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -1.0730 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -0.3220 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 0.7230 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 1.3110 0.9860 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2730 1.4240 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 2.6730 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 2.8180 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 1.7150 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 4.0230 -1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 4.1550 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 5.3880 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 6.2570 -2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 5.5250 -1.3890 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9860 0.3870 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1270 0.8420 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2170 0.0080 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1640 -1.2880 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0320 -1.7430 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9300 -0.9060 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 -1.3960 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -1.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 0.7420 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -0.6040 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 -0.8120 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -2.1570 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 -0.7930 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -2.1460 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -0.5860 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.7520 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0140 3.4690 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 2.6700 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 3.3610 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 5.6320 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 7.2630 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1660 1.8540 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1070 0.3680 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0110 -1.9450 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9970 -2.7570 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 M END