IFLAB-ZINC04583603 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -1.5480 1.0150 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.2370 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.8480 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -2.5370 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -0.9250 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.1130 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -4.7270 -1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.8460 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -4.2320 -4.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -6.1880 -3.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -6.9060 -5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -8.4070 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -9.1460 -6.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -9.3770 -6.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -10.0550 -7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -10.5010 -8.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -10.2700 -7.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -9.5960 -6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -11.3640 -9.9720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -11.2010 -10.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -10.9760 -10.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -12.9760 -9.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.8800 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 0.9520 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 1.1180 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1620 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.2050 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -3.4330 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.5660 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.2870 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -6.6780 -2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.7180 -5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -6.5590 -5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -8.5940 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -8.7540 -4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -9.0290 -6.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -10.2350 -8.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -10.6180 -8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -9.4190 -6.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -13.2710 -8.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -13.6250 -10.3320 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 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 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 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END