PUBCHEM-ZINC05785343 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0760 1.5460 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0330 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.5570 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -2.3660 0.3830 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -2.8140 0.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4510 -2.2580 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -4.3170 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -4.8050 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -4.0240 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -2.3260 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -1.1590 1.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 1.9540 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.8290 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 2.0130 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -0.3910 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.2080 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -0.1330 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -0.3160 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -4.8860 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -4.6020 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -5.9690 -1.5530 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.8900 -3.1300 2.3480 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END