IBS-ZINC05271325 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.3960 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0070 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -0.6820 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0200 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4320 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1110 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.1480 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 3.3650 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 1.4010 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 0.0060 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -0.6270 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 2.0560 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 2.2760 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9380 2.9600 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4010 3.1760 2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7050 2.8190 3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5890 3.7670 3.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 4.0630 4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1470 4.7670 4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5140 5.0550 5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6880 4.6260 6.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5340 3.9320 6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2070 3.6770 5.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.9200 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.5380 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.7620 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.1910 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 1.4250 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 3.0170 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 2.9060 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6470 1.3140 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 2.3290 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 3.9210 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1780 3.9860 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7660 5.0850 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4220 5.5990 6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 4.8340 7.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 3.5970 7.4080 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 M END