PUBCHEM-ZINC03601674 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.1780 1.5040 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -0.0070 0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6360 -0.4700 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.5110 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.3600 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -1.8100 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -1.4320 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -0.5880 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.1340 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -1.9000 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -1.5710 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 -2.2150 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6210 -2.7410 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -0.4470 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -1.5960 1.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.8530 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 1.7750 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.0620 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -1.6800 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -2.4680 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -0.2640 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 0.5170 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -2.5150 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -1.9130 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -0.4850 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5450 -3.2070 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 0.3850 2.2360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 3 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 M CHG 1 27 -1 M END