PUBCHEM-ZINC04655664 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 67 0 0 1 0 0 0 0 0999 V2000 -0.2910 1.8700 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 0.3810 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 0.1900 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -0.3670 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -0.0080 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -0.6720 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -1.7030 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -2.0830 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -1.4330 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -1.8040 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -2.9310 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -3.0640 0.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0980 -2.1220 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -4.2140 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 -5.6480 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -5.4560 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 -6.8830 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -3.3360 2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -2.6650 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -3.0700 3.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.5350 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -4.4530 5.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0040 -5.2520 5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -5.0390 7.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -5.8450 9.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -6.7420 9.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -4.5450 10.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -3.7150 6.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -3.1600 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 2.3840 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 2.3720 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 2.0090 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.0170 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.6270 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -0.8740 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 0.6660 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 0.7990 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -0.3770 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -2.1870 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -2.7790 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -3.8320 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -3.9970 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -5.1420 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -5.7150 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -5.3280 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7190 -4.5730 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -6.3220 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -7.0670 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -6.7880 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -7.7740 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -4.0970 4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -2.6820 5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -5.8700 6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.2630 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -6.3820 9.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -6.2540 9.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -7.6810 9.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -6.9960 10.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -3.9130 9.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -3.9650 10.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -4.7540 11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -4.4270 0.0490 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7360 -4.4140 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -3.5900 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -5.5480 7.9080 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.8180 7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -6.3750 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 15 62 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 55 1 0 0 0 0 25 65 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 65 66 1 0 0 0 0 65 67 1 0 0 0 0 M CHG 1 62 1 M CHG 1 65 1 M END