PUBCHEM-ZINC05854900 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -3.6170 0.4000 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 1.1810 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 0.9810 -2.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 2.1770 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 2.8850 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 2.8630 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 2.2910 -3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 2.6820 -5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 3.4690 -5.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 3.5810 -4.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 4.1190 -4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 4.1020 -6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 3.9810 -7.7000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2630 1.4200 -2.9340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2510 1.1660 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 2.0270 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 0.8190 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -0.1830 -3.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 0.1010 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -0.6100 -4.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -1.3880 -3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -2.4260 -2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -3.1640 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -4.1100 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -4.3250 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -3.5940 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -2.6460 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 3.7480 -1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -0.5160 -4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 0.9800 -4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 0.0940 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 2.3400 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 2.4150 -5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 2.6200 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 2.6840 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 1.0180 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.4620 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -1.8050 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -1.1220 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -2.9960 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -4.6730 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -5.0600 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -3.7590 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -2.0790 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 4.1870 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 4.7400 -6.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 46 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M CHG 1 13 -1 M END