PUBCHEM-ZINC05119462 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 -0.0800 1.2790 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.2540 -0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8570 -0.8620 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.7710 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -1.3220 2.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6510 -0.6900 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -0.9390 1.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3440 0.1260 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -0.9170 -0.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1860 -2.2790 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1040 -1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.6430 -1.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0720 -0.0690 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -0.3650 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -1.2100 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 -0.4450 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 -0.9020 -2.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 0.8490 -2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.9940 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -0.1410 -1.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -1.5780 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -2.9830 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -3.0840 2.9790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4180 -2.7800 2.8720 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8200 -2.8560 4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -4.1790 5.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -4.4930 5.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1100 -3.7950 5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -4.4070 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -5.8020 5.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -6.4240 4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -3.8740 2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -4.8360 1.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -2.0560 3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.7070 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.7660 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.5700 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.9030 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -0.3470 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.2270 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 0.2900 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -3.0590 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -2.6120 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.8330 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -2.3110 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -2.2670 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 1.3500 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 1.7290 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -0.6760 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -0.9250 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -1.5860 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -3.2170 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -3.7060 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.7190 4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -2.0360 4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -5.0050 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -4.1420 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -4.4890 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -5.2850 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -2.1830 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -3.7150 2.0790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 34 60 1 0 0 0 0 M CHG 1 61 -1 M END