PUBCHEM-ZINC06622437 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.1150 1.5170 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 0.1730 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -0.1650 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -1.0620 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 0.9860 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 1.9880 -0.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -0.7770 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -1.0570 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -2.1680 -2.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -2.0130 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -2.9240 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -0.8730 -3.3130 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5840 -0.2650 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 0.9390 -1.7460 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6690 -0.3430 -4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 -0.8040 -4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 -0.2870 -5.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -2.9940 -4.4900 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1180 -2.8600 -5.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -2.7510 -5.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -3.6020 -6.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 2.1120 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 1.0640 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -1.7100 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -0.3290 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 0.7460 -4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -0.7100 -5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 -1.8930 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -0.4360 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8690 -0.5400 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -1.7100 -5.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -2.9710 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -3.5010 -7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -4.5020 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -4.3640 -3.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -4.5830 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END