PUBCHEM-ZINC05581662 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0990 0.7100 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.5510 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -0.8430 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 0.1460 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 1.4300 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 1.6800 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 2.4310 -0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 3.0000 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 3.0400 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 3.7150 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 3.0470 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 3.0490 -1.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2450 4.0960 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 2.4470 -2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 1.3880 -3.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -0.2320 0.9070 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5510 -0.6620 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -0.1610 2.1320 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0850 0.9460 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -1.3020 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -1.8290 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 2.6570 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 4.0200 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 2.4520 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 3.5720 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 2.0210 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 4.7780 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8150 3.6620 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 3.5670 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 2.0190 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 3.1120 -3.2970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 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 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 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 11 30 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 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 31 -1 M END