IFLAB-ZINC04140085 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 1.7180 0.4360 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.4540 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -0.9760 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.7810 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -2.0420 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -2.3610 -2.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5100 -1.9580 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.0030 -3.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2300 -2.3600 -4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.6420 -3.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -3.7930 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -4.2870 -3.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -4.4220 -2.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.8870 -2.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2620 -4.2640 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -3.8560 -0.0640 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -5.6500 -1.0970 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -3.6290 -1.0830 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -4.4260 -3.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -5.6710 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.5080 -3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 0.2450 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 1.6180 -4.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 2.1860 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.4380 -3.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 0.1290 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -0.1480 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 1.2650 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 0.8280 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -1.2820 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.1310 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -2.2230 -4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -5.3900 -3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -5.9190 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -6.4740 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -5.5480 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -0.2260 -5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 2.2360 -5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 3.2540 -4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -0.4520 -2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 32 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 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 M END