PUBCHEM-ZINC05420358 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 38 0 0 1 0 0 0 0 0999 V2000 -0.1000 1.2830 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.1660 -0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0650 -0.8040 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.5150 1.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5340 -0.1840 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0380 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.5760 2.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -2.7270 0.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -4.1820 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -4.6700 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -3.7350 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.0820 2.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 1.3420 2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 2.1080 2.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 1.6990 3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 3.0370 4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 3.3930 5.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4600 2.5850 6.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 4.6980 6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 5.4680 6.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -0.4930 -0.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.5220 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.4520 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.9970 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -2.2810 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -4.4810 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -4.6220 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.5120 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 1.7280 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 0.9000 4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.9920 4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 3.8360 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 0.3300 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -5.9200 -0.7950 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2450 4.8110 6.6490 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0400 3.6360 5.6910 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6450 2.9680 6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 3.8260 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 4.5780 6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 21 33 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 -1 M CHG 1 36 1 M END