PUBCHEM-ZINC05093729 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.3700 0.6400 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 1.4680 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 1.0940 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -0.1190 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -0.9370 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.5610 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.5660 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -0.1210 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -0.7240 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -0.3150 -3.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -0.3290 -4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -0.6920 -4.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 0.2490 -5.9680 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8290 0.1350 -5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 1.7590 -6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 2.0810 -6.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 1.3960 -7.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.1130 -7.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.4680 -7.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1280 -0.1120 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -1.9860 -7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -2.3110 -6.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -0.1880 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -1.1890 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -0.8610 3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5350 0.4720 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 1.4770 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 1.1510 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 0.9330 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 2.4080 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 1.7680 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -1.8770 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -1.2070 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -1.6660 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 0.9720 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -0.4370 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -1.8180 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -0.4270 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -0.0460 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 2.2300 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 2.2160 -6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 1.7750 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 3.1660 -6.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 1.6030 -8.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.8180 -8.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.5660 -7.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -0.5350 -8.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -2.2360 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6600 -1.6450 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 0.7260 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 2.5170 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 1.9550 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -2.7260 -7.9020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 53 -1 M END