PUBCHEM-ZINC05632645 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 0 0 0 0 0 0999 V2000 -0.1650 1.6100 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.0790 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.4240 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.5360 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -0.1550 1.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -0.5630 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.0470 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -0.5300 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -1.2170 -3.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -0.2210 -2.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -0.7090 -4.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -0.2390 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 -0.7600 -5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 -0.2940 -5.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -0.5950 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2880 -0.0850 -6.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2100 -0.3520 -7.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8220 -1.1450 -8.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5280 -1.6660 -8.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -1.3880 -7.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7780 -1.4320 -9.6490 N 0 3 0 0 0 0 0 0 0 0 0 0 12.9160 -0.9520 -9.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3910 -2.1380 -10.5910 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8200 2.0720 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.9810 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.9780 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.1750 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -1.5120 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.0280 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -0.2000 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -1.6300 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -0.3380 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 1.1380 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.3520 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 -1.8040 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -0.3590 -4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 0.8580 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -0.5770 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -1.8570 -5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 -0.4040 -6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 0.2870 -4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6060 0.5350 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2120 0.0660 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2020 -2.2860 -9.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6200 -1.8070 -7.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.3840 -1.0400 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6990 -1.4150 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.1080 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 46 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 46 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 46 1 M END