PUBCHEM-ZINC03594113 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 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 0.8630 -2.4990 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -2.6440 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.0900 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -5.1610 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -5.2680 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -6.5030 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -7.6080 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -7.5370 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -6.2950 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -5.8940 2.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -6.4600 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -4.5560 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -3.6400 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -2.5070 1.9510 N 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 -0.9990 -2.0670 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -2.5630 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -4.4150 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -6.6180 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -8.5560 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -8.4060 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -3.9000 3.1850 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 19 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 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 M END