IBS-ZINC05137412 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.8430 -2.2700 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -1.1170 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -0.2800 -0.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.8530 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 2.1090 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.5600 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 0.2330 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.0480 -3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -1.1170 -4.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -1.9080 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -1.6300 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -1.4200 -5.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5380 -1.3450 -6.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -2.8360 -5.7940 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3260 -3.0560 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -3.8490 -5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -5.2600 -5.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -5.3580 -4.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -4.3340 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -2.9300 -4.6630 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9690 -1.8920 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 -0.5000 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 0.9020 -6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 1.7750 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 1.3120 -7.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 3.0720 -7.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -2.6690 -3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -1.8690 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.8700 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.8940 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -0.5170 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -1.5180 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 1.0170 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.6360 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 1.9440 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 2.3250 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 2.9510 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 1.0670 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 0.5680 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -2.7420 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -2.2460 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -3.7810 -6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -3.6370 -4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -5.4720 -6.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.9840 -5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -6.3610 -4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -5.1550 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -4.5380 -5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -4.4030 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -2.1090 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 -1.9270 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 0.2420 -5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -0.2780 -4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 0.8680 -6.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 1.3110 -5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 3.4420 -6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 3.6340 -7.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -2.7120 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -0.4570 -6.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 59 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 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 59 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 M END