PUBCHEM-ZINC05851585 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.1240 1.4680 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 0.0870 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.6130 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.0650 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 1.4540 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 2.1510 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.6880 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -0.9210 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 -1.9180 -3.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9980 -1.9730 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 -3.2310 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -4.3480 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -3.9210 -1.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 -0.7780 -3.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -0.0680 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 2.0120 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.4460 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.6910 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 2.0020 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 3.2270 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -0.1240 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -1.6470 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -1.5230 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 0.0210 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 -3.5520 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -3.0880 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -1.6660 -1.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0080 -1.1310 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -2.6440 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -5.5130 -2.6690 O 0 5 0 0 0 0 0 0 0 0 0 0 7.1810 -0.6920 -4.5730 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 27 1 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 2 0 0 0 0 12 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 30 -1 M CHG 1 31 -1 M END