IFLAB-ZINC04032227 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 1.6820 0.5840 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.4470 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -1.1400 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.0860 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.3450 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -1.6610 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -0.7000 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0130 -2.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.6640 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 0.0580 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.5790 -5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -1.9190 -5.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -2.5210 -6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -3.7790 -6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -4.4520 -5.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -3.8730 -4.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.6030 -4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.0210 -3.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -4.5430 -3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -5.8420 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 1.4080 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 2.1470 -6.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.8800 -6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 3.3430 -5.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 4.4720 -6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 5.5290 -6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 5.4690 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 4.3660 -3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 3.2820 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 2.0800 -4.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 0.1070 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 1.3590 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 1.0310 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -0.9430 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -2.6250 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -3.0860 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -1.8650 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.1100 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -2.0010 -7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -4.2440 -6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -5.4380 -4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -6.4880 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -5.7650 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -6.2650 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 4.5240 -7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 6.4080 -6.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 6.3040 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 4.3310 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 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 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 M END