PUBCHEM-ZINC00339336 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.6110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.0490 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1150 1.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1900 -2.4830 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -2.6730 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -3.4660 2.7580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -2.5720 3.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2920 -1.5860 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.5120 2.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.8750 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -2.6490 2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -3.5870 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -3.4220 4.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -3.9970 5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -4.7340 6.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -4.8940 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -4.3270 4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -1.8660 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -3.4100 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -3.8750 6.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -5.1840 7.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -5.4640 6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -4.4460 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M END