IFLAB-ZINC05250686 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.3570 -5.6270 -8.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -4.3460 -7.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.1600 -8.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -1.9850 -7.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -1.9960 -6.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -3.1810 -5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -4.3560 -6.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -3.1950 -3.5680 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -4.4840 -3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.9910 -3.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -3.0820 -3.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -1.9420 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -1.9940 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -0.8690 -4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 0.3140 -4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 0.3660 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -0.7610 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 1.4540 -4.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 2.5140 -3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 3.8420 -3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 4.2700 -5.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 3.3450 -6.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 1.6550 -5.9020 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 0.7060 -6.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 1.5780 -5.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -6.1070 -8.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -6.2950 -7.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -5.4060 -9.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.1520 -9.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -1.0590 -7.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -1.0780 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -5.2810 -5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -3.8070 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 -2.9140 -4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -0.9090 -5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 1.2860 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.7210 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 2.6000 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 2.2660 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 4.6070 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 3.7310 -4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 4.2130 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 5.2960 -5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 3.6670 -7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 3.3730 -6.5340 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 M END