PUBCHEM-ZINC00136562 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 0.9000 -0.0610 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -1.2580 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -1.5320 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -0.6110 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 0.5960 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 0.8580 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 1.5710 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 2.6980 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 3.1940 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 2.3620 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 1.3690 0.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2070 2.4190 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 2.0040 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 1.5200 3.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 1.4860 3.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 1.1870 4.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 1.4520 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3030 1.2140 5.5500 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 1.9580 3.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.9700 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -0.0640 -2.9280 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0220 0.1540 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -1.9840 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -2.4760 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 1.7790 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 3.0860 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 4.0580 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 2.7910 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 0.8090 5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3370 2.2400 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -2.1770 -2.1250 O 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 2 0 0 0 0 M CHG 1 21 -1 M END