CHEMDIV-ZINC06780684 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.6110 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.2920 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -4.2550 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -3.5750 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -5.8260 -5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -6.8340 -5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -7.5620 -6.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -8.5080 -6.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -8.7570 -6.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -9.2570 -8.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -10.2230 -8.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -9.8590 -8.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -8.7320 -9.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -10.8600 -8.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 -10.8390 -9.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3240 -12.1110 -8.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -12.8700 -8.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -12.1240 -8.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -12.4060 -7.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -11.5240 -7.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0180 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.9910 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -4.3700 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -3.5330 -4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.9380 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -4.8750 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -3.4960 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -4.3330 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -2.9280 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -6.3530 -5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -5.1220 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -7.5390 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -6.3070 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -7.3640 -7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -8.5530 -8.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -9.7850 -8.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3360 -10.0000 -9.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3380 -12.4320 -8.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -13.9020 -7.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -13.3940 -7.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -5.0960 -4.0590 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 58 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 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 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 M END