PUBCHEM-ZINC00346030 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 1.0380 2.0040 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 0.5500 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.0020 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.3430 1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.1440 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.6300 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.2680 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.2560 -2.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 0.6760 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 0.3680 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -2.5560 -1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -1.9130 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.1220 3.7040 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9630 2.1030 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 2.4970 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.5460 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 0.6340 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.1910 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 1.1350 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 1.4200 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.1740 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -0.4830 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 0.3930 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 1.2880 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -2.3830 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -2.4130 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -3.6050 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -3.1430 3.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 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 17 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 2 0 0 0 0 M CHG 1 13 -1 M END