PUBCHEM-ZINC04654716 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 1.8930 2.0170 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 0.5380 -0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5050 0.4350 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -0.0300 0.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4730 0.1090 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -1.5240 1.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0790 -1.6610 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -2.2280 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -1.5750 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4690 -1.7050 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -0.1800 -1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -2.1890 -2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -1.9150 -3.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3230 -2.4840 -4.8800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5080 -3.5540 -4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.2260 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -2.7470 -5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -3.0590 -6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -3.5410 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -3.8720 -7.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -4.3390 -6.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -4.4870 -5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -4.1700 -4.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -3.6960 -4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -3.3760 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.9130 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -2.6000 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -2.9090 -2.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -3.5140 -2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -4.3140 -3.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 -4.6580 -7.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -1.7540 -5.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0400 -2.1800 -6.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -0.2980 -5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 0.3380 -4.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.4340 -3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 0.1560 -2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 1.7880 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 2.2470 -4.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 2.7100 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 0.3240 -6.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -1.8680 -4.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -1.8610 -4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -2.0780 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 0.6490 2.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 2.1200 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 2.4210 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 2.5650 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -2.1330 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -3.2820 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -1.1530 -6.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.7180 -6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -2.9360 -7.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -3.7610 -8.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -4.8520 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -4.3860 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -5.1850 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -5.5790 -8.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 2.1240 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 3.4040 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 3.2700 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.1220 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -1.9520 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.7000 -5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -0.9270 -5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 -3.0240 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.6020 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 44 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 8 50 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 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 34 41 2 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 37 62 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 42 43 1 0 0 0 0 43 63 1 0 0 0 0 43 64 1 0 0 0 0 43 65 1 0 0 0 0 44 66 1 0 0 0 0 45 67 1 0 0 0 0 M END