PUBCHEM-ZINC05415549 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.2500 1.5260 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.0680 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.2240 1.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3190 -0.9160 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.9640 1.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.8340 -0.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7310 0.0870 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -0.9560 -1.2240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -2.1050 0.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0380 -1.9300 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -1.9340 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -2.4920 2.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -3.3480 -0.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -4.3080 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -4.2330 -0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -5.3570 -1.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -6.4930 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -7.7530 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -8.9490 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -8.6400 -4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -7.3870 -4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -6.1880 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 1.0430 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 1.5310 2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.4110 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 1.9010 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.6410 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 2.1860 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -3.4890 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -5.3320 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -6.6620 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -7.9910 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -7.5700 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -9.2270 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -9.8120 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -9.4930 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -8.5030 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -7.5760 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -7.1560 -5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -5.9040 -4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -5.3260 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2620 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -1.4740 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 0.1460 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.4600 2.8500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 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 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 45 -1 M END