PUBCHEM-ZINC05162260 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0200 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 2.1220 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 2.9740 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 3.6260 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 4.4610 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 3.5600 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 2.9100 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.7070 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6980 -1.9250 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.0870 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7620 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 3.7490 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 2.3670 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 4.2710 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 2.8520 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 5.2600 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 4.1570 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 2.7850 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 2.2560 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 3.6850 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 5.5990 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 5.0430 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 5.5860 0.7670 H 0 0 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 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 30 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 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END