PUBCHEM-ZINC05580974 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.0530 0.5440 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -0.7020 -0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -0.6310 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -1.6150 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -1.2310 1.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 0.0840 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 1.1050 0.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 0.6780 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.4160 -0.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 2.8500 -0.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8360 3.2850 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 3.2410 -2.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5760 2.5730 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 4.6090 -2.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1650 4.9200 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 4.4160 -1.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4940 3.9810 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 3.4130 -0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 5.7000 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 5.5390 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 6.7810 0.7940 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 6.1610 1.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 5.7980 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 5.4620 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 6.9460 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 7.8770 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 5.5990 -1.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 5.1410 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 3.4200 -2.7150 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6310 0.5970 2.0700 I 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -2.9520 0.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 0.8780 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 5.9380 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 6.5340 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.2420 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -3.6070 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 21 26 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 27 28 1 0 0 0 0 31 35 1 0 0 0 0 31 36 1 0 0 0 0 M CHG 1 29 -1 M END