IBS-ZINC05452123 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0.0290 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -0.6390 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 -2.0360 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -2.7530 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -2.0830 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4120 -2.7540 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 -2.1300 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 -4.1020 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7130 -4.8140 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 -6.3230 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7740 -7.0550 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5310 -7.3690 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 -8.0180 0.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5660 -8.1190 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4270 -7.5350 -1.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1290 -7.4680 -2.1460 H 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 4.8770 1.1090 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -0.0840 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -3.8330 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -2.6370 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 -4.6000 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 -4.5380 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 -4.5460 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 -6.5990 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 -6.5910 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3020 -7.1380 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3070 -8.5930 -1.4190 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 28 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 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 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 31 1 0 0 0 0 12 32 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 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 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END