PUBCHEM-ZINC05895228 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.7320 0.6580 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 0.9360 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.1550 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 0.3720 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -0.4190 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -1.4360 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -1.6500 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.8600 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -2.2870 -4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -3.5740 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -4.2260 -5.7940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -2.6660 -6.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -1.8300 -5.1800 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4520 -0.4450 -5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -0.3900 -4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 1.0690 -4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6610 1.1220 -3.9230 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7970 1.1100 -4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8300 1.1720 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 1.2230 -2.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 1.2740 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 1.1950 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -2.3760 -7.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -3.3950 -8.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 -4.6650 -7.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -5.6420 -8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 -5.3270 -9.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -4.1140 -10.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -3.1570 -9.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 0.7760 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -0.3640 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 1.3520 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 1.1600 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -0.2500 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.4370 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.0280 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.1150 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 -0.0740 -6.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 0.1740 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -0.8570 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -0.9230 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 1.5360 -5.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 1.6020 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 1.0590 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8800 1.1800 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 1.2250 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -1.4650 -7.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -4.8830 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -6.6380 -8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -6.0850 -10.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -2.1780 -9.8400 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 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 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 M CHG 1 13 1 M CHG 1 17 1 M END