IBS-ZINC02149314 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.0630 1.4050 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.1010 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -0.8330 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.2140 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.8640 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.1320 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.7500 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.6250 -0.1400 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -4.9750 -1.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -5.0610 1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -5.1370 -0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -4.8140 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -5.6930 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -5.3560 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -6.2210 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -7.0250 -1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 -6.0990 -3.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -6.9770 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 -6.7990 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7980 -7.6730 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8750 -8.7550 -2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9850 -9.7080 -2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0030 -10.7380 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9690 -10.8630 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9980 -11.7900 -5.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 -9.9860 -4.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8780 -8.9400 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 -8.0390 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1240 -11.7440 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0770 -9.5520 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 1.7820 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.7920 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 1.7310 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.3260 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -2.7860 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.6390 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.1790 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -5.6500 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -3.7650 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -4.9980 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -6.7420 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -5.5090 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -4.3060 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -5.5390 -3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 -5.9640 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5640 -7.5300 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -8.1680 -4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9320 -11.4100 -4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7560 -12.7100 -4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4960 -11.8400 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8770 -8.9370 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4710 -10.5330 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6710 -9.0720 -0.8950 H 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 28 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 27 2 0 0 0 0 22 23 2 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END