IBS-ZINC02424505 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 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 -5.5910 -2.6060 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -2.8630 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -3.2910 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1030 -2.5820 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4220 -3.0250 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6460 -4.1020 1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6440 -4.7510 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3830 -4.3600 2.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 -5.8770 2.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1980 -6.2950 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0980 -5.6860 2.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5020 -7.5200 3.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9880 -7.7710 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5520 -8.5710 2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9140 -8.8010 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7140 -8.2320 3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1510 -7.4330 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7870 -7.2060 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 -1.3940 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -0.8880 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 -0.8230 0.0590 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 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 -5.0040 -3.7480 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -2.2890 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2390 -2.4970 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 -6.3640 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9870 -8.3810 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1630 -7.3640 4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9270 -9.0150 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3550 -9.4250 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7790 -8.4110 3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7750 -6.9880 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3460 -6.5850 5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -0.2610 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2090 -0.1720 -0.7940 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 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 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 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 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 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 31 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 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 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 47 1 0 0 0 0 22 48 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END