PUBCHEM-ZINC01973759 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -2.7480 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -3.2650 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -3.3740 -0.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -2.7110 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -2.4940 -2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -2.8120 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -3.2880 -3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -2.5760 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -3.0190 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -2.7800 -7.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -3.5860 -7.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -3.1430 -6.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -3.3830 -5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -3.6950 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.5290 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.6080 3.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -1.4090 4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -2.1210 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -3.0360 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -3.2480 3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.9030 6.5010 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0290 -1.0970 7.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -2.5280 6.8770 O 0 5 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -2.1140 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -1.5150 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -4.0800 -5.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -2.4450 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -3.0950 -8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -1.7190 -7.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -4.6470 -7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -3.4160 -8.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -3.7180 -6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -2.0820 -6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -3.0670 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -4.4440 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 -2.8540 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -4.5130 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -4.0280 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -1.0510 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -0.6960 5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -3.5880 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -3.9670 2.3750 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 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 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 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 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 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 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END