PUBCHEM-ZINC05923813 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.2480 1.6040 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 0.0790 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.6460 0.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -0.4510 1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -0.3420 -1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.2790 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.9200 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.4950 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -3.1290 3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -4.1880 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -4.6170 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -3.9900 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -4.4150 -0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -5.5180 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -4.8630 4.2050 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0730 -4.4860 5.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -5.7960 3.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7500 2.0400 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 1.9680 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.8900 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.2060 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -0.2850 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -2.7920 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -1.6680 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.7970 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -5.4450 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -5.7540 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -5.2550 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -6.3850 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END