IBS-ZINC02131912 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.5180 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0110 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5390 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0680 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -2.5740 0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -3.9010 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -4.6780 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -4.4120 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -5.7840 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -6.2500 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -7.5830 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -8.8800 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 -9.9520 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2890 -9.7440 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8040 -8.4670 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 -7.3710 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1810 -6.0090 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0600 -5.5970 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 -5.3200 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 -3.9510 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -3.5530 0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7670 -2.9460 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 -3.0370 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8300 -2.0960 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8050 -1.0630 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 -0.9680 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -1.9070 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -1.8160 1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -0.7280 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8540 -2.1820 -1.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8670 -1.1780 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.8940 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.9070 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.8410 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.3340 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.4000 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.2160 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -0.1500 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -2.3910 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -2.4570 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.9540 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -6.4770 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -9.0460 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 -10.9580 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9580 -10.5900 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8730 -8.3160 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -3.8390 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6000 -0.3310 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 -0.1620 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -0.7730 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 0.2150 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -0.7980 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4200 -0.1970 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6220 -1.3640 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3340 -1.2070 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END