PUBCHEM-ZINC00967786 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 2.0350 1.0620 6.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.3900 6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.5480 5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -0.3730 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -0.0430 3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 0.1130 1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.0520 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.3740 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.5370 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.8400 3.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.9800 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -0.8490 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -1.0740 7.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -1.3480 6.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -1.2900 5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -1.4950 5.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -1.8050 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 -1.9160 7.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.6240 7.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -1.6300 8.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 -2.3070 8.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -3.3760 8.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -1.9540 5.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8360 -3.3970 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -4.0110 3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7020 -1.3600 6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0390 -0.2070 5.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4860 -1.1340 3.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 0.4310 1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 1.1390 7.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 1.6910 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.4750 7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.8070 5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -0.9880 7.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 0.0970 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 0.0710 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.4990 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -1.9440 7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -0.1850 7.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -1.4480 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -2.6760 9.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -1.4420 8.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -2.9220 7.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -4.0630 5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 -3.4070 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 -4.9980 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -3.3960 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -4.1470 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0970 -0.3870 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 0.5150 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1990 -2.0770 6.9390 O 0 5 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 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 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 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M CHG 1 51 -1 M END