IFLAB-ZINC04518718 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1380 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4820 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -1.8590 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -2.6320 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0070 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.7530 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -3.0960 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -4.1110 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -4.8210 1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -6.1540 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -6.7890 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -5.9960 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -4.6800 3.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -6.8670 4.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -8.1270 3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -9.1320 4.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -8.1080 2.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -8.8870 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -6.4990 5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -6.3350 6.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -5.9730 7.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -5.7740 7.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -5.9370 6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -6.3040 5.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -6.4680 4.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -6.9440 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -8.1580 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -6.3160 -0.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2160 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1140 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -2.3380 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -3.6900 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.1850 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -3.6730 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -6.4890 6.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -5.8450 8.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -5.4920 8.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 -5.7820 6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -5.3470 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -6.8330 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 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 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M END