PUBCHEM-ZINC04772054 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.1330 1.1300 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.3290 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -1.1900 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.4290 0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.4320 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.0790 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.5000 -2.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -0.3670 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -0.5940 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -0.4800 -1.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -0.1530 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -0.0640 -2.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 0.0800 -4.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 0.3140 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -0.0140 -4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 0.1910 -5.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -0.7180 -0.5740 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5180 -0.1330 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -0.3660 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.7150 1.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0980 -1.6680 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -2.7230 0.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9590 -2.8530 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -2.1240 -0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -4.0670 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -5.0170 -0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -2.0690 2.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -3.6230 -1.6340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2780 -4.8260 -1.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -3.4800 -2.9430 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8670 1.5620 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.5100 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.4030 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.9090 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.8580 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 0.0300 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 0.3490 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -3.9440 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -4.4230 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -5.8940 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -1.4360 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END