IBS-ZINC06760532 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7890 -2.4840 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.5900 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -3.2130 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4260 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -3.6310 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -4.4100 -0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -4.0100 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -5.4180 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -5.7860 -4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -5.6210 -5.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -4.3340 -5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -3.9820 -3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -6.8630 -6.3090 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -6.2670 -7.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -7.7030 -6.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -7.8070 -5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -7.4890 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -8.2290 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -9.2890 -4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -9.6070 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -8.8680 -4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -10.0130 -3.7750 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -1.8040 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -3.3010 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -5.4430 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -6.1310 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -5.1300 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -6.8230 -4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -3.5590 -5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -4.4120 -6.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -4.7080 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -2.9850 -4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -6.6620 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -7.9800 -5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -10.4330 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -9.1180 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -2.3720 1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -2.7330 1.1780 H 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 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 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M END