PUBCHEM-ZINC05572812 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 0.4550 -1.3230 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -0.5880 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.3670 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -2.8400 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -0.3600 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 1.1660 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 1.5130 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 2.8460 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4260 3.1280 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 4.4490 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 5.5110 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 5.2240 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 3.9000 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 6.9260 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7510 7.2960 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 8.6160 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 9.1750 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 10.4260 -3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 11.1210 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5630 10.5650 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 9.3150 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 7.8900 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 9.0010 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 9.8870 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 9.6560 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 8.5550 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 7.6680 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 10.5080 -2.9040 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -1.0350 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.0780 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -2.4070 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.4940 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.8330 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -2.4300 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.9660 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -2.9220 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -3.8340 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -2.1650 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.7260 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -0.7650 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 1.5160 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 1.6050 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 2.3160 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 4.6390 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 6.0310 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 3.7360 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5050 6.5810 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 8.6410 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 10.8570 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8690 12.0950 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0960 11.1050 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1140 8.8940 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 9.1840 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 10.7510 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 8.3960 -4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 6.8080 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.9140 -0.6840 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7390 -0.3800 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 57 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 52 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 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 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 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END