IBS-ZINC05274145 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.0970 1.3840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 0.0020 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -0.6760 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.0380 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 1.4340 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 2.0970 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -0.6790 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 0.0100 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -0.7070 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -2.0380 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -2.3410 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2550 -1.1800 -0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -0.1420 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6950 -1.0400 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9650 -0.9430 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6890 -0.4710 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1830 -0.1900 -3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9820 -1.4260 -3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6360 -1.7790 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1280 -2.0140 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1040 -3.7040 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2370 -4.0820 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7490 -5.3550 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1430 -6.2590 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -5.8960 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -4.6230 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -4.2670 -1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 1.9090 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -0.5480 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -1.7550 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 1.9920 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 3.1760 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -1.7580 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 1.0890 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0550 -0.1360 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 -1.9070 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6050 -1.8460 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 -0.0760 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 0.4130 -3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4020 -1.3090 -4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3930 0.0410 -4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4680 0.6570 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7260 -2.2630 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0480 -1.2160 -3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1690 -2.6840 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9280 -0.9580 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8390 -2.8450 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8770 -2.2520 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 -3.3790 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6270 -5.6470 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -7.2540 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -6.6060 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -3.8840 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4090 -0.8020 -2.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 M END