PUBCHEM-ZINC03748635 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.0160 1.3930 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.1170 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7790 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.1930 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -2.9500 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -2.2810 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.8810 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.0110 -3.2560 I 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -4.3370 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -4.3870 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.0970 2.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.8420 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -5.5490 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -5.5030 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -5.7100 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -6.4430 -0.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.0090 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 1.7740 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 1.7250 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 1.8730 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.8670 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -6.1940 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -5.2320 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -6.1400 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -6.4200 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -5.3410 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.5820 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.6650 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 0.6530 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -5.1620 -2.3230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 17 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 9 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M CHG 1 30 -1 M END