IFLAB-ZINC04263711 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -0.1710 1.7210 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.2260 -0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 -0.1120 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.0380 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.1550 2.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4460 1.2150 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.6690 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -0.5850 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -0.9590 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 0.0100 -0.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0900 -0.0420 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 -0.2440 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 0.6690 -0.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8460 0.3930 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6700 -0.3390 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0070 -0.5840 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5340 -0.0960 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7160 0.6500 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 0.9170 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 1.7190 -3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7310 0.8460 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8630 0.8450 -5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8160 -0.2710 -2.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6950 -1.0160 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 1.3400 0.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 1.9390 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.2190 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 2.2690 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.8880 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 2.1650 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -1.0700 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 0.6110 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.7470 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -0.4310 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -0.3180 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -1.6610 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -1.0570 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -1.9510 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -1.2830 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -0.0340 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3040 -0.7240 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6070 -1.1590 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1340 1.0270 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 2.4040 -3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 2.3700 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 0.1850 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 1.4870 -5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 0.1910 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3400 -2.0430 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8360 -0.5200 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6690 -1.0600 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 0.3880 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.0500 4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -1.2730 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.3290 0.9300 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3590 0.6850 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 55 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 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 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END