PUBCHEM-ZINC06072011 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 0.4320 0.9720 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.5140 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -1.0510 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.4020 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -3.2000 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -4.3980 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.6910 -1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -3.2800 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -1.3640 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.9010 -2.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.9860 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -3.3450 2.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -2.2350 3.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8600 -1.3590 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -2.5700 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -2.8500 1.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -3.8530 0.9720 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5020 -4.8560 0.6280 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.0250 -1.9430 4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.0430 5.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 1.2080 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 1.2870 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.4960 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -0.4180 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -3.8750 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.2570 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -3.4460 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -1.7240 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.7980 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -1.0390 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -2.9260 6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 M CHG 1 17 1 M CHG 1 18 -1 M END