PUBCHEM-ZINC05061388 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -4.0200 -1.1800 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -2.3770 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -3.1400 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -3.2630 -0.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -4.3260 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -5.2280 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -4.3380 -1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -4.9840 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -5.6030 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -6.8730 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -6.9910 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -5.7830 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -4.9520 0.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -5.2280 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.0060 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -3.4680 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -4.1330 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -5.3590 4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -5.9000 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -3.5400 6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -2.4640 6.8340 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9800 -3.5810 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -3.7270 -4.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -2.6480 -3.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -2.3960 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -1.1040 -2.0800 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -0.6980 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -0.6560 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -2.8610 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -4.1340 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -2.6630 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -4.9950 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -7.6240 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -7.8500 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -3.4510 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -2.5140 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -5.8980 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -6.8480 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -2.0720 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -4.1590 7.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 22 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 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 40 2 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 21 -1 M END