IBS-ZINC05947040 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 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 0.0280 -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 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -0.9370 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.5880 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -1.9540 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -1.8340 -2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 -2.5420 -3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -2.6900 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -1.7090 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 -3.3180 -4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 -3.4660 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -4.3640 -6.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -3.7370 -6.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 -3.5890 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 -4.5100 -8.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -3.9520 -8.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 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 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -1.5420 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 -1.9760 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 -3.5300 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3920 -2.6770 -4.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -4.2990 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -2.4840 -6.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8720 -3.9120 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8490 -5.3460 -6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -2.7550 -7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -4.3770 -7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -4.5710 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -3.1420 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 -5.2590 -9.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4630 -5.3230 -10.0690 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 41 42 1 0 0 0 0 M END