PUBCHEM-ZINC03190383 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.5180 2.2040 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 0.7060 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.0250 -0.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -0.3620 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -1.6680 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -0.4710 -2.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -1.6020 -2.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -0.4850 -1.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 0.8240 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 1.8340 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 2.8500 -4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 2.8570 -5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 1.8470 -5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 0.8280 -4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.2560 -4.9040 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9440 -0.1820 -5.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -1.2220 -4.1670 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5470 2.3890 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 2.5400 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 2.7490 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 0.3650 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 0.5220 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4820 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 0.4390 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.4690 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -1.9180 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -1.5480 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.8290 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 3.6390 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 3.6520 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 1.8530 -6.4510 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 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 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