IBS-ZINC06754787 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.6110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.0490 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1150 1.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2760 -2.5370 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.6320 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -3.8100 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.2840 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -2.5490 2.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.3140 3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -1.6930 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -2.8100 4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.5610 5.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -3.0350 7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -2.9760 8.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -2.4170 9.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -2.5350 10.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -3.2070 11.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -3.7650 10.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -3.6580 9.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -4.1110 8.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -4.6130 8.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -3.7490 7.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -3.9560 6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.4930 4.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -4.7050 6.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -5.5320 5.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 -6.2270 5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -6.1030 6.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -5.2820 7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -4.5790 7.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -6.7860 6.3290 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -2.9840 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -1.8570 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -4.7190 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -3.9770 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -4.1160 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -2.6150 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -2.0100 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -1.8920 8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -2.1010 10.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -3.2940 12.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -4.2860 11.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -5.6290 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -6.8680 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -5.1890 8.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 -3.9360 8.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 26 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 M END