PUBCHEM-ZINC02141671 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -1.8880 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -2.3660 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4830 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -0.1200 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 0.3580 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -1.9950 0.0420 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6000 -3.1950 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 -1.2160 0.0560 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 0.1300 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -2.5790 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -3.4310 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 0.5700 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 1.4220 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -0.1600 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 1.2160 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.2350 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 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 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END