IBS-ZINC04898275 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4310 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 2.1530 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 1.4940 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 0.1010 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6570 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -1.9200 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 -1.9890 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 -0.7860 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.5400 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 4.2320 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 5.5300 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 6.2580 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 7.6550 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3920 8.3230 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 7.5750 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 6.1940 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 5.5800 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 -0.5430 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 4.0310 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 6.0770 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 8.2060 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 9.4020 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5230 8.0670 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 5.6110 -0.0540 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 M END