PUBCHEM-ZINC05887405 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.8720 1.3220 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 0.0770 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.7660 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.7090 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -1.9650 -1.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6740 -2.6370 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -1.6610 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.4520 -2.6310 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -1.2610 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -2.7250 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 -2.5940 -2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -3.5190 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -3.5230 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -4.4070 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9790 -3.9540 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -5.8270 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -5.9170 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -6.1160 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -6.1860 -3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -6.0540 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -5.8580 -4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -5.7910 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -6.1200 -6.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -5.9410 -6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -4.6280 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -4.3560 2.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 1.9160 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.9610 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 1.0500 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.4300 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -1.6050 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -0.1630 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -1.1700 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.9970 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -0.0300 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -2.4850 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -0.7620 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -6.2280 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -6.5150 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -6.2090 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -6.3360 -4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -5.7510 -4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -5.6290 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -5.0440 1.7950 O 0 5 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 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 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 44 -1 M END