PUBCHEM-ZINC06168272 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.6330 1.6360 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 0.2230 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.8500 -1.4870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7100 -0.7260 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -0.6880 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -2.2460 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.7230 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -4.0090 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -4.8400 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -4.3810 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -3.0860 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -5.1840 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -6.0070 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -6.7650 -3.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -5.9500 -4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -5.1210 -3.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -6.1330 -5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -7.5760 -6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -8.2060 -6.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -6.0970 0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -7.0260 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -8.4170 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 1.9630 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 1.7020 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 2.3390 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 0.1950 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 0.0030 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -1.5050 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 0.2480 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -0.6830 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -2.0970 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -4.3680 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.7270 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -6.2010 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -5.8410 -6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -5.4780 -6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -6.9960 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -6.7880 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -8.6680 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -9.1660 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -8.4690 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -7.9640 -5.8610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 42 -1 M END