IBS-ZINC06645563 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.4940 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0360 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.5070 1.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.7340 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.1790 3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -1.4120 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -1.8070 4.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -1.1500 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -0.7030 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -0.4550 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -0.6530 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -1.1030 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -1.3420 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 -1.2130 0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -0.4380 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -0.4850 -1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.4170 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.1240 4.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -1.9600 5.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -2.3000 6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -2.8950 8.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.2450 9.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -3.0390 9.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.8800 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8440 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8480 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.4210 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.3890 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -0.5620 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.1080 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -1.6900 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 0.5890 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 -0.8930 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.1250 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -1.4000 7.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -3.0280 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -3.7950 7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -2.1670 8.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.7860 10.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -3.9930 11.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 39 40 1 0 0 0 0 M END