IFLAB-ZINC01787230 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0650 1.5330 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.0030 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.5340 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -2.0410 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.7370 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -4.1180 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -4.8060 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -4.1060 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -2.7240 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -6.1650 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -6.8070 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -8.3250 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -9.0120 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -10.5070 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -10.9760 -1.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -11.3220 -3.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -12.7050 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -13.3250 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -14.6900 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -15.4400 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -14.8260 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -13.4620 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -15.6330 -4.9350 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4840 -16.8360 -4.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -15.0930 -5.9040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9560 1.9150 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.8910 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 1.8820 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.3460 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.3550 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -0.1850 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -0.1760 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.2000 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -4.6610 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -4.6390 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -2.1780 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -6.5280 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -6.4950 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -8.6040 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -8.6370 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -8.7330 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -8.7000 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -10.9500 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -12.7390 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -15.1720 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -16.5070 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -12.9840 -4.9790 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 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END