PUBCHEM-ZINC02046529 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 0.1890 1.8580 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.3660 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.1260 0.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3170 0.0770 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -0.6930 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -0.5220 -3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 0.4300 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 1.2100 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 1.0390 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -1.6730 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -2.3300 0.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 0.7310 1.9940 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.0640 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.7510 4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -1.7670 3.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -2.0010 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -2.3070 4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.4570 5.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 2.0840 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 2.1640 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 2.4760 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -0.1740 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 0.1110 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -1.4450 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -1.1340 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 0.5660 -4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 1.9590 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 1.6840 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -0.7830 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 0.7250 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -2.1160 1.4130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 31 -1 M END