PUBCHEM-ZINC05497035 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.0350 1.6050 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.0660 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.5950 1.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8360 -0.3950 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -2.0970 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -2.0690 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -0.5550 0.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2310 -0.2960 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.1130 1.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0410 -0.8440 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0920 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 1.1790 1.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 1.4270 3.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4880 2.8500 2.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8320 2.9350 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 3.1450 3.8420 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3120 3.2890 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 2.0340 3.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1440 2.0230 2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 0.7010 4.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6280 0.6760 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 0.4580 3.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 -0.4050 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 -1.5690 3.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 2.3340 4.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2730 1.4730 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 4.3950 3.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 4.3930 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 3.8870 3.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 4.7190 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 1.3500 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -0.3880 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.9490 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 2.0050 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 2.0850 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.5850 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.6460 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -2.5250 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -2.6230 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.7560 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.9080 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 1.9350 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 1.7080 5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 0.3160 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -0.0230 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -1.4690 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.0180 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2660 0.0110 4.3610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 42 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 M CHG 1 48 -1 M END