IBS-ZINC05033577 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2460 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.9130 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.3780 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -7.0110 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -8.3550 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -9.0260 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -10.3920 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -11.1300 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -10.4990 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -9.1060 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -8.3790 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -8.9710 -3.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -7.0270 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -6.2860 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -5.9010 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -5.1700 -5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.8210 -5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -5.2000 -5.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -5.9380 -4.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -6.3160 -3.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.7910 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -4.3680 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -8.4660 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -10.9050 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -12.2090 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -11.0780 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -6.1720 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -4.8710 -5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -4.2490 -6.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -4.9240 -5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -5.6760 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 M END