PUBCHEM-ZINC02076157 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.5810 1.3420 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -0.1150 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.7360 1.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -2.0580 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -2.8680 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -4.2050 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -4.7540 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -6.0940 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -6.6530 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -5.8830 3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -4.5330 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -3.9490 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.6000 2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -3.7260 4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -3.8530 5.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -3.0030 7.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -2.0960 6.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -3.3910 8.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -4.4350 8.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -4.9130 9.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -5.9850 9.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -7.3000 9.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -8.3710 9.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -8.1470 8.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -6.8200 8.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -5.7500 9.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -9.3050 8.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -10.4740 8.9980 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5360 -4.9500 6.5290 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -2.7370 9.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -6.3650 4.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -7.7190 4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -7.9420 6.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 1.8460 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 1.8650 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 1.4240 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -0.5990 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.1680 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -2.4960 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -4.8180 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -6.7190 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -7.6850 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -1.9400 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -2.9800 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -7.4940 9.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -9.3900 9.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -6.6210 8.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -4.7320 8.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.9090 9.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -2.3620 9.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -3.4720 10.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -7.9200 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -8.4010 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -8.9710 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.7400 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -7.2600 6.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -9.0180 8.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 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 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 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 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 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 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 57 2 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M CHG 1 28 -1 M END