PUBCHEM-ZINC02956501 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -3.1060 -2.6940 1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -2.9060 0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -3.2670 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -2.5500 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -2.9170 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -3.9890 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -4.6920 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -4.3340 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -5.1500 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -6.1730 -1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -4.6630 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -5.2570 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -4.6380 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -5.1920 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -5.0430 1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 -5.5920 2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -6.2920 3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -6.4440 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -5.8940 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -6.6270 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -6.8060 -0.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -7.6020 0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -7.3620 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -9.0510 0.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6850 -9.2990 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -9.5580 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -9.2020 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -9.9960 1.6480 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -9.4370 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -9.7990 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -9.0700 1.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -2.7730 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -1.6860 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -3.4510 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -1.6920 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -2.3620 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -4.2760 -3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -5.5250 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -3.7700 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -3.6550 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -4.5160 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -5.4870 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 -6.7310 3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -7.0010 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -6.0340 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -9.1510 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -10.6500 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -9.5440 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -8.1240 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 -9.8170 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 -8.3450 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 -9.8170 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -11.0160 0.8810 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 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 31 2 0 0 0 0 30 53 1 0 0 0 0 M CHG 1 53 -1 M END