PUBCHEM-ZINC06228663 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -2.5030 -2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -3.8090 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -4.6580 -1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -4.2080 -3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -5.5150 -4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -5.9160 -5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -7.2710 -5.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -7.6390 -6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -6.6710 -7.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -5.3290 -7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -4.9450 -6.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -7.0750 -8.9200 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2730 -8.2560 -9.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -6.2260 -9.6840 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.4910 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.5070 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -1.8270 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -3.4560 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -6.2680 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -8.0270 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -8.6850 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 -4.5790 -8.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -3.8970 -6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 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 29 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END