IBS-ZINC02093185 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7450 -0.4790 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -2.0070 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.4730 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -2.0180 0.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4380 -0.5020 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1840 -0.0790 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.6540 -2.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2920 -1.7330 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0620 -2.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1670 1.1380 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.4690 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -0.2510 -3.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -0.0490 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 0.2560 -5.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -0.2870 -3.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5070 0.6230 -3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -1.4410 -4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -2.1040 -6.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -1.6280 -7.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -2.7420 -8.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 -2.7620 -8.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -3.8100 -8.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 -4.5660 -9.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -5.0060 -9.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -3.7540 -9.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 0.0440 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -2.4930 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.5790 -1.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -4.0070 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.1440 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.0610 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.4260 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3400 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -3.5600 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -2.0400 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -0.4810 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 1.0080 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -0.0580 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.5580 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -2.2970 -4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -1.7200 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -2.3880 -5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -2.9650 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -0.7680 -7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -1.3450 -8.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -1.9760 -7.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8900 -4.5110 -7.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5330 -3.3330 -9.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 -5.4420 -10.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 -3.9110 -10.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -5.5410 -8.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -5.6530 -10.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -3.3230 -10.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -4.0290 -8.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -0.2300 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -2.0680 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1690 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -3.5810 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -4.3550 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -4.3730 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -4.3850 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -1.0190 -5.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -0.1880 -5.6240 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 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 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 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 67 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 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 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 67 68 1 0 0 0 0 M END