PUBCHEM-ZINC06067127 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.1040 1.9620 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.4730 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2900 0.3560 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.3300 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.1570 1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -1.7030 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -2.5950 3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -2.9320 4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -2.3970 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.5110 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -1.1820 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.3560 0.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.1520 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -1.3850 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.3460 1.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1760 0.5940 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -0.0780 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 0.5690 -0.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 0.6220 -2.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -0.9630 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -2.0980 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 2.3130 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.5920 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 2.1450 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.0180 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -3.6200 4.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 -2.6740 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -1.0980 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -2.4150 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -1.3160 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -0.2530 1.7190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 M CHG 1 31 -1 M END