IFLAB-ZINC04279301 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.3540 1.3430 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.1500 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -0.6720 1.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.8320 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.3050 -0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0200 -2.6720 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -2.8550 0.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0410 -2.3480 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -4.3760 0.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2570 -4.7420 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -4.6590 -1.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0410 -4.1070 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -4.2000 -1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -2.7860 -1.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6260 -2.3070 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -2.3700 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -2.7890 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.1140 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -1.7340 -3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -1.1450 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -0.9400 -5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -1.3280 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -1.9150 -5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -6.1380 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -6.9390 -0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -5.0320 0.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -5.5550 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -5.4390 2.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -6.2880 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -2.5500 1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -2.4160 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -2.4740 1.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -2.1500 3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 1.8280 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 1.6810 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 1.6230 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -0.3010 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -3.8740 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.5270 -4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -1.8970 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -0.8500 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -0.4830 -5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -1.1770 -7.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -2.2200 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -5.5870 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -6.7570 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -7.0720 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -2.9400 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -1.1750 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -2.1450 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -6.3670 -2.8700 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 M CHG 1 51 -1 M END