PUBCHEM-ZINC06891744 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 -0.4900 1.6720 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.1470 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -0.3960 -1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -1.7310 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.4220 -1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.3670 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -3.8860 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -4.5050 -3.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -6.0660 -3.7100 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -6.3950 -4.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -6.1490 -2.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -7.0930 -3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -7.8320 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -8.6370 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -8.7030 -3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -7.9640 -4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -7.1550 -4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -6.3590 -6.0180 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2090 -6.5110 -7.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -5.5520 -5.9830 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5190 2.0680 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.9560 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 2.0800 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.1370 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.2490 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -2.1110 -4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -1.9990 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -4.1420 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -4.2540 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -3.9990 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -7.7800 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -9.2140 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -9.3330 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -8.0150 -5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END