PUBCHEM-ZINC05561408 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 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 -2.0750 -0.1660 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -1.9630 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.4160 0.4950 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4540 -2.1750 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -3.9040 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -4.4060 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -5.7700 2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -6.6360 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -6.1350 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -4.7640 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -6.9840 -1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -1.7420 1.6450 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -0.6040 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 0.9180 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -0.5540 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -2.2030 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -2.4770 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -3.7310 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -6.1600 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -7.7020 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -4.3710 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -7.1870 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -1.9100 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 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 18 1 0 0 0 0 2 19 1 0 0 0 0 2 31 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 M END