IFLAB-ZINC04338252 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.6790 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -4.0530 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -4.6100 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -3.7870 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.3980 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -1.5880 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -4.3820 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -3.5780 0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -4.0700 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -5.4550 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 -6.2720 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -5.7050 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -7.5810 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -7.5710 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 -8.5600 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 -6.2990 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7750 -6.0230 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -8.7260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -9.9870 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -11.1130 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -10.9840 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -9.7260 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -8.5980 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -12.0860 -0.0400 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -3.1650 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8770 -3.6270 0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -1.8290 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.2500 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -4.6940 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -5.6840 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -1.3490 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -10.0890 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -12.0950 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -9.6270 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -7.6170 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -1.4600 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3420 -1.2370 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M END