IBS-ZINC01295717 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 43 0 0 1 0 0 0 0 0999 V2000 -0.0310 1.4390 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0540 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.6800 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 0.0390 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 1.4570 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 2.1740 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 1.8730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 0.7460 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -0.3540 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -1.2750 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 0.7400 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 2.1370 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 3.2720 0.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8210 3.2200 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 3.2830 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 4.4770 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 5.6450 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 3.9840 -0.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 2.6440 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 1.9690 -1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 4.7750 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 6.1580 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0710 6.9350 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1010 6.3390 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 4.9620 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3450 4.1790 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5320 4.2170 -3.9570 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 1.9580 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.4720 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -1.7600 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 3.2530 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 0.3500 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 0.1360 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 3.6980 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 3.8950 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 6.6240 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 8.0100 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8010 6.9490 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 3.1040 -2.3580 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 15 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 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 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 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 39 1 0 0 0 0 M END