IBS-ZINC02397856 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0050 1.4760 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.0310 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.6240 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -0.7980 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -2.5740 0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.2090 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -2.4870 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -3.1220 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -2.5640 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 -3.3730 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -4.7590 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -5.3260 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -4.5140 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -4.9170 0.0310 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 -5.5780 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -6.7440 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2070 -7.1260 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4790 -7.5740 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2000 -8.8380 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4550 -9.6680 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3440 -9.4720 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4950 -10.2330 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7570 -11.1910 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8680 -11.3880 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7140 -10.6300 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.8490 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.8370 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.8300 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -0.5440 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.5370 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 -1.4910 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2190 -2.9320 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 -6.4000 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0260 -5.3040 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8000 -7.8530 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 -6.9950 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -8.5590 -2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4140 -9.4170 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1400 -8.7240 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1900 -10.0800 -3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6570 -11.7860 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0720 -12.1360 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0180 -10.7860 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END