PUBCHEM-ZINC04530266 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 0.0230 1.6510 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.1340 0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7600 -0.3220 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.4910 -0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8510 -0.1210 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.0430 -0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8000 -2.4070 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.6290 -0.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2190 -2.4370 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -4.1380 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -4.5750 1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -4.9130 -0.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -6.3770 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -6.9920 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -6.1320 -3.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.0060 0.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.4560 -1.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -3.3570 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.0270 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -0.6220 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.0670 1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 0.0260 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 2.1710 0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 1.6470 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 1.9050 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 2.1520 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -4.5280 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -6.6630 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -6.7440 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -2.7500 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -8.2510 -2.2260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 31 -1 M END