ASINEX-ZINC04944790 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1820 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5100 1.4850 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 3.0570 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 4.2080 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 4.6210 2.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 4.7840 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 4.3180 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 3.0540 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 2.6020 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 1.4910 -2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 3.4190 -3.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 3.1250 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 4.6540 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 5.0840 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 5.4690 -4.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.0860 -0.0410 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -0.3540 -1.1840 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.3640 1.1000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 2.4600 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 3.4420 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 5.5330 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 5.1640 -5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 6.3520 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M END