IBS-ZINC02343624 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 -2.1350 -0.1310 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -0.6380 -1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 0.0340 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -0.7120 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -1.9380 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -1.8650 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -2.8750 -2.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -3.9620 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -5.0480 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -6.1480 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -6.2180 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -5.1890 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -4.0340 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 -3.0200 -1.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3490 -0.2380 -0.4380 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.0770 -1.4440 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1920 0.7450 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 0.5780 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -0.1520 -2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3890 0.4860 -3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2560 1.8590 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5380 2.5880 -3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 1.9470 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8280 2.4880 -5.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6510 3.9030 -5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 1.3000 -0.2320 N 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 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 0.9560 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -0.5540 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -5.0070 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -6.9780 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -7.1030 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -5.2590 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9080 -1.2210 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9470 -0.0850 -4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4340 3.6570 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 2.5150 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0740 4.3780 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5870 4.1330 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1560 4.2780 -6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 1.7750 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 1.7130 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 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 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END