IBS-ZINC05451706 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 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 -2.0350 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.6230 -0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -2.7240 -0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -4.0960 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -4.7870 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -6.1990 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -6.8550 -0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -6.8520 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -6.0800 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -4.7270 -0.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -6.8600 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -6.3900 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -7.2620 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -8.6270 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -9.1100 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -8.2280 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -8.5540 -0.6680 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -4.0680 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -4.0760 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -3.4060 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -2.7240 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -2.7130 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -3.3860 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 -2.0640 0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -1.3830 1.4000 C 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 0.2320 -0.1590 2.1380 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 -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 -3.4190 -2.2530 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -5.3310 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -6.8910 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -9.3100 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -10.1720 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 -4.6060 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -3.4120 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -2.1810 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -3.3810 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8880 -2.1000 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -0.6300 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8750 -0.9000 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END