PUBCHEM-ZINC04774171 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.4520 1.9910 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 0.2100 -0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -0.4000 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -1.7650 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -3.0030 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -3.4290 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -4.7410 -0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -5.5950 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -5.3150 -1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.0050 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -3.4350 -1.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -2.0850 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 -1.2310 -1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 0.0400 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 0.4870 -0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 1.2360 -1.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 2.6360 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -4.1240 -1.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4740 -3.4370 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 -4.6840 -3.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5280 -5.0640 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -5.9190 -3.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2500 -6.6880 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -6.4010 -1.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2310 -6.9850 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -5.2290 -0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 -7.1930 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -7.6550 0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -6.8730 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 -5.5030 -3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 -4.6670 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 -3.8420 -4.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0490 -2.6040 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 2.5030 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 2.2090 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 2.3790 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -6.6370 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 3.4440 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 3.0120 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 2.3510 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 -6.5760 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -8.0660 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -1.6090 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -3.0340 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 33 43 1 0 0 0 0 33 44 1 0 0 0 0 M CHG 1 32 -1 M END