PUBCHEM-ZINC03876867 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.6980 1.4390 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -0.0510 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -0.6460 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -2.0110 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -2.7860 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -2.1860 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -0.8200 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -3.0080 -2.5920 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.4800 -3.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -4.2120 -2.5110 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1670 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -5.0120 1.2230 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -6.3860 0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.3580 2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -4.7980 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -5.6850 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -5.5170 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1150 -4.4620 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -3.5750 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -3.7460 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6060 -4.2780 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3160 -5.5150 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0310 -3.0460 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9860 -4.0860 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 1.9330 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 1.6660 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 1.7950 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -0.0430 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.4750 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.3530 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -4.6320 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -6.5100 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 -6.2100 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -2.7500 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -3.0550 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 -5.6520 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3950 -5.3820 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -6.3930 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 -2.1640 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1100 -2.9130 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 -3.1830 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -4.9640 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0640 -3.9530 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 -3.2040 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 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 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END