IBS-ZINC04137467 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.5280 0.9880 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.4620 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.8090 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -2.1390 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -3.1230 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -2.7770 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.4460 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -4.5740 0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3540 -4.6930 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -5.0790 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -6.1250 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -6.2820 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -7.1000 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -5.3860 -0.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -5.2430 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -6.1380 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -4.6400 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -7.0060 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -6.7880 -1.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -4.6080 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.6860 1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -5.1130 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -5.5900 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 -6.0610 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 -6.0640 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -5.5930 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -5.1120 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 -5.5990 -3.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 -6.1040 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 1.2840 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 1.1280 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.6020 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.0400 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.4100 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -3.5460 -2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.1750 -2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -5.5390 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -4.2040 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -5.8420 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -7.1770 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -4.4370 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -3.9140 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -4.5610 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 -8.0020 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -6.8900 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -6.8780 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -3.4170 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -5.5890 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -6.4280 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1600 -6.4350 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -4.7420 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9350 -7.1400 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 -5.5040 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -6.0530 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -5.9950 0.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 55 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END