IBS-ZINC01438234 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.0820 1.5460 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0160 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -0.4830 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -1.8340 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.6610 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -4.0340 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -4.5860 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -3.7670 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.3900 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -1.5830 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -4.9310 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5170 -4.3220 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -5.8160 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -6.8620 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -7.2320 2.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -7.3880 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -6.9780 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -5.8000 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -5.3860 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.0570 -3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -7.9850 -2.7120 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -9.3590 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -10.3750 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -10.1890 -4.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -11.4900 -3.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -12.3770 -4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -11.9220 -5.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -12.7990 -6.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -14.1300 -6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -14.5860 -4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -13.7150 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -14.2140 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -15.0850 -7.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 1.9270 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.9010 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.9000 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.3370 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.3390 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.2320 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -5.6590 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -4.2000 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -1.3480 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -6.3030 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -5.2020 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -8.0630 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -9.8260 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -8.9830 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -11.6780 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -10.8820 -5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -12.4460 -7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -15.6260 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -14.1260 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -15.2590 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -13.6190 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -15.5270 -7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -15.8730 -6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -14.5460 -8.1130 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 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 3 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 M END