PUBCHEM-ZINC06344454 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.4270 0.4240 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 1.4590 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 1.1820 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -0.1340 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -1.1680 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8900 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.4990 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.3370 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 1.5570 -0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 -0.3830 -0.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 0.2830 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 -0.7130 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 -0.0510 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4960 0.3300 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7580 0.9140 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2760 1.1180 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5390 0.7730 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2780 0.1890 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9200 1.8570 -1.0910 S 0 0 0 0 0 0 0 0 0 0 0 0 13.8310 2.5220 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9950 2.7620 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9480 0.6430 -1.0450 N 0 5 0 0 0 0 0 0 0 0 0 0 14.7540 0.0840 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 0.6430 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 2.4870 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 2.0180 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -2.2030 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.7010 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -1.4860 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -1.3870 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2080 0.8700 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 0.9900 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4030 -1.3160 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2540 -1.4320 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1040 0.1640 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3330 1.1960 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9440 0.9450 -3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7150 -0.0870 -2.7750 H 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 22 -1 M END