IBS-ZINC06661310 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.6150 1.3580 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0050 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6340 0.0770 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.4620 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -1.2280 1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -0.0170 1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -0.5370 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -1.0490 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0620 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 0.4660 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.9910 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 -0.4200 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 0.3290 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -0.4160 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 -0.1490 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 -1.6010 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 -1.5910 -0.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4060 1.7260 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 2.2400 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -0.9790 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -1.0850 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.3730 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -2.0660 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -2.8860 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 -3.8000 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -3.9070 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -3.1000 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -2.1750 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -1.3830 -4.0080 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 2.0650 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 1.7200 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 1.2610 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 0.2600 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -1.3550 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -1.3460 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -1.9070 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.2460 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -0.4010 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 1.1820 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 1.9140 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 -2.4200 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9180 1.7110 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9430 2.3730 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 3.1610 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 2.4350 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.5470 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -2.8040 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -4.4340 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -4.6260 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -3.1900 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 1.2290 1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 1.6270 2.1340 H 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 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 51 52 1 0 0 0 0 M END