IBS-ZINC05055037 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.5120 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.0060 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.6580 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -2.0400 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.7580 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.0950 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -0.7130 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.2650 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1080 -4.8090 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -4.3600 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -4.8180 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -4.3040 -2.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4700 -3.2150 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.7510 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -4.8360 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -4.3910 -4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -4.2860 -4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.7720 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -4.3750 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -4.7440 2.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -3.8210 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -4.1900 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -3.3240 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 -4.1070 4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -5.3980 4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -5.4450 3.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 1.8800 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.8520 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.8940 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.0960 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -2.5580 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -2.6560 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -0.1950 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -5.8980 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -4.4230 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -4.7800 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -3.2720 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.3230 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -5.8380 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -5.9250 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -3.3020 -4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -4.7700 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -4.7830 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -4.6030 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -4.6650 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -3.1970 -4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -5.8570 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -4.3300 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.2980 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -4.8940 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -2.7810 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -2.2470 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 -3.7440 4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -6.2530 4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 M END