PUBCHEM-ZINC03105155 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.4270 1.7570 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 0.2500 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.4750 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 0.1220 -0.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -1.9640 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.6300 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -4.0260 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -4.7750 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -4.1120 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -2.7120 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -6.1280 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -6.9370 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -8.3850 0.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3620 -8.4760 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -9.3560 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -11.7760 0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1770 -11.3300 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -12.1110 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -12.9720 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -13.0860 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -14.1610 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -15.1340 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -15.0300 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -13.9550 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -8.8190 -1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -8.1060 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 2.2470 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 2.0260 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 2.1560 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.1050 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.0250 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -2.0720 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -4.5280 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -4.6490 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -2.2390 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -6.8340 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -6.6450 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -9.1560 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -9.3530 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -12.3970 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -12.9380 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -11.2520 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -12.3410 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -14.2390 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -15.9710 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -15.7890 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -13.9080 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -10.7230 0.2720 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6030 -11.0650 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -10.5470 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 48 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 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 47 1 0 0 0 0 25 26 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END