PUBCHEM-ZINC05488977 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 1.3430 1.3360 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.0220 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.6890 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -1.9350 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -2.4870 -0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -1.7650 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.5460 -1.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.5260 -3.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -1.1300 -4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.6140 -5.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -2.2370 -5.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -1.3010 -6.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -1.6570 -7.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -1.1360 -8.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -0.5070 -7.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.7320 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 1.2880 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.7200 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 2.0400 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -0.2570 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.3220 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -0.7440 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -0.7940 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -1.2370 -8.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.7480 -7.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -2.1820 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -3.6900 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.9380 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -1.3970 -9.6740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M CHG 1 29 -1 M END