PUBCHEM-ZINC05576023 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -5.2350 -1.3170 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -1.1220 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -2.1040 0.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -2.1950 0.0720 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -0.4880 0.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -3.1290 1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -3.6360 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -4.5810 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -3.0280 -1.8780 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -4.6630 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -4.5180 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 -3.4400 -1.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -5.5870 -1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -5.4770 -1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 -4.6380 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -4.5320 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6230 -5.2590 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9540 -6.0950 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -6.2100 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0970 -5.1420 -0.8180 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.6880 -4.4060 -1.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7190 -5.7820 0.0110 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.9530 -0.5680 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -2.3130 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -1.2090 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -1.2290 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -0.1250 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -4.1780 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -2.8070 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -4.0390 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -5.4100 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -4.9680 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -5.2990 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -5.1130 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 -6.4330 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -4.0700 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -3.8800 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -6.6610 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -6.8670 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 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 4 9 1 0 0 0 0 6 7 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 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END