IBS-ZINC02230999 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.5430 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -1.9240 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.7550 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -3.1140 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.0280 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -4.6210 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2640 0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6710 1.2710 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 0.3240 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 0.7010 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4590 0.3360 -3.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 0.4800 -4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 -0.2280 -2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -0.2750 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 -0.7010 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -1.2540 0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -0.3920 0.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -0.6660 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 0.5230 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6610 0.6550 2.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 1.3760 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 2.6720 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 3.2960 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 2.6420 -4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 1.3590 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 0.7210 -3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -0.5390 -2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -2.4230 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -3.6910 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.2110 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -3.7150 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 -4.3000 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -5.7070 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -4.3090 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -1.5610 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 -0.8210 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 0.3590 4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 1.4340 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0660 1.3910 3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 3.1850 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 4.2990 -4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 3.1380 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 0.8540 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -1.2340 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 13 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 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 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 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 33 54 1 0 0 0 0 M END