IBS-ZINC04090637 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 0.1070 1.5500 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 0.1010 0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0510 0.0790 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.9860 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8960 1.0040 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 0.4460 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 1.2720 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 0.7330 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -0.6330 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -1.4710 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.9280 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -1.7440 2.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.0090 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.7600 3.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -2.7420 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -1.3960 3.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 2.7640 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 3.1960 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 2.9200 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.6450 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -0.7490 -0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -1.2600 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -1.9530 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -2.4840 -4.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -3.8330 -4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -4.0750 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -3.2230 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -0.5400 0.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -1.8740 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -2.5310 0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 2.0910 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.5660 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.0260 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.9400 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 0.4360 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 1.3840 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.4860 4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -2.6710 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -1.0720 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -2.9530 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -3.4580 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 3.0400 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 3.2660 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 4.2390 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 3.0800 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 2.3290 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 2.9110 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 3.9460 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -1.9920 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.4810 -2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -1.2680 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.6260 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -1.7850 -5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -4.6300 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -3.7890 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -5.1300 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -3.7350 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -2.9720 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -3.7420 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.0040 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -2.3580 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 2.3450 1.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 62 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 62 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 62 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 27 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 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 M END