PUBCHEM-ZINC02870665 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0540 1.4750 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.0290 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -0.5480 0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -2.1440 -0.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -2.3850 -0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -2.3680 -1.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -3.0540 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -3.2700 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -4.0160 3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -4.5460 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.3210 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -3.5780 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -5.4290 3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -6.8810 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -7.8470 4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -7.3480 5.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.8880 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.7320 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 1.9640 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.4840 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -0.2580 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.1250 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -2.8790 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -4.2060 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7490 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -3.4250 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -5.3020 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -5.1040 4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -6.9970 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -7.1940 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -9.0550 4.5120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 M CHG 1 31 -1 M END