PUBCHEM-ZINC04152542 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.5200 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0080 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.6350 0.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -0.4010 1.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -0.2930 -1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.2810 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -3.0410 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -4.5090 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -5.3260 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -6.6920 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -7.2520 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -6.4470 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -5.0780 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -2.4810 0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -1.0720 0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.8970 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.9160 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8380 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.3250 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.4030 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -4.8900 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -7.3260 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -8.3230 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -6.8900 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -4.4500 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -3.0510 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -0.7740 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 M END