IBS-ZINC02226946 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -1.3210 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.7990 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -0.6880 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2140 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -2.0040 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5080 -2.8570 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -0.9170 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -0.0420 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 0.6460 -0.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 1.3410 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0890 0.2360 0.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 -0.7160 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 -1.6490 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 -1.7350 2.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 -2.3930 1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1460 -3.4230 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -2.7890 3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -3.8500 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -4.5460 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -5.5200 4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -5.7990 5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -5.0980 5.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -4.1200 5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -5.3690 7.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -4.6100 7.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -6.7570 6.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -7.4360 5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 0.1330 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 1.3330 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 1.4910 -4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 0.4620 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 -0.7310 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2090 -0.9070 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -2.0810 -3.2900 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.5680 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -2.4200 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -0.4410 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 0.4040 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -3.8760 2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -4.1900 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -2.3370 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -2.0230 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -4.3290 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -6.0620 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -3.5710 5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -3.5510 7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 -4.7760 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -4.9250 8.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -6.7150 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -8.1720 6.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -7.9400 4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4890 2.1380 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 2.4200 -4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 0.5930 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -1.5300 -5.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7560 -2.1100 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 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 47 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 65 1 0 0 0 0 36 37 2 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 67 1 0 0 0 0 38 39 1 0 0 0 0 39 68 1 0 0 0 0 M END