PUBCHEM-ZINC03869470 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.6610 0.5500 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.0180 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 0.1850 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.4090 -2.1130 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0170 -0.8910 0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -0.3910 0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1750 0.5500 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -0.1010 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -0.9140 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -2.1680 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -2.4320 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -1.4500 -0.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1830 -2.0040 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -0.8090 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -0.5840 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 0.5060 3.5430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3200 0.3670 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 1.2030 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 0.8140 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -2.8900 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -3.3640 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.3660 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 0.9170 -1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -1.4300 3.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 23 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 M CHG 1 4 -1 M CHG 1 16 -1 M END