IBS-ZINC03985246 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8220 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.7360 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.6950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3600 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 -0.1680 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 -0.1910 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 0.4060 0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 -0.8760 2.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 -0.9090 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6550 -0.5510 3.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7200 -0.7840 3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9670 -1.3780 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 -1.1010 4.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9540 -1.6110 5.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9330 -1.6020 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 0.3880 4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 0.7970 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 2.1570 5.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5860 3.0640 4.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8030 2.6090 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 3.4040 3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1300 1.2940 4.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4880 0.9250 3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 0.2380 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 1.6900 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 0.2660 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -1.1860 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4590 -1.9090 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4990 -0.1930 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1520 -2.4380 4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3540 -1.0930 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 -1.4010 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 -2.6720 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 0.0660 5.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 2.4830 5.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 4.1190 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1440 1.1870 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 1.5050 2.8730 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 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 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M END