IBS-ZINC02118903 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.8480 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 3.0850 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 3.1220 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 1.9990 -0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.8050 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 0.6790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.4060 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -1.3320 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -0.4100 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 -0.4150 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -1.5480 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -2.6820 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 -2.6820 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -1.5510 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1710 -3.7900 -0.1020 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 4.4270 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 5.4580 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 4.4730 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 5.7660 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0620 5.5380 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 6.8880 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 7.9260 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4620 7.6430 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8540 7.0160 -1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1690 5.7880 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6620 6.0530 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 4.0000 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 0.4680 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7370 -1.5520 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -3.5680 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -1.5510 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 3.6500 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2590 6.3330 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 6.3240 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3520 4.9710 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3370 4.9800 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4910 7.4550 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5060 7.4460 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6440 8.3520 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7400 8.6310 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0060 8.5800 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6870 6.9810 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5010 5.3840 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3850 5.0730 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4390 6.7270 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1320 5.1120 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2340 6.6690 -0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 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 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END