IBS-ZINC04974026 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 0.0300 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -0.6380 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 -2.0360 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -2.7540 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -2.0830 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -2.7520 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 -4.0510 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6530 -4.7320 -0.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -6.0800 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -6.7040 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9640 -6.7970 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1660 -6.0760 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3620 -6.7260 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4010 -8.1250 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1980 -8.8560 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9840 -8.1910 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5620 -10.1890 -0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9610 -10.9500 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9200 -10.2360 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4110 -9.0290 -0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9850 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 1.1090 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -0.0820 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -3.8330 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -2.6370 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 -2.1980 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4860 -4.2340 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 -4.9960 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 -6.1610 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0590 -8.7480 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5080 -11.1420 -0.1830 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 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 15 16 1 0 0 0 0 15 38 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M END