IBS-ZINC06661008 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0240 -0.7640 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1080 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.8570 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.2660 3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.9100 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.1730 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7960 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1060 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7120 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6950 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0430 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 0.2000 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -0.2430 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 0.8340 -4.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 0.9870 -4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 1.7250 -5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 3.1090 -6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.7450 -7.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 2.9840 -8.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 1.6700 -8.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 1.0310 -7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.7120 4.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -1.6860 5.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.5210 5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.8600 5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.7480 7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 1.6320 5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 1.6000 5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.9710 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.9890 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.5210 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.0270 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 1.1890 -4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 1.5510 -3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 0.0030 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 3.6770 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 4.8210 -7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 3.4730 -9.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -0.0470 -7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -1.7890 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 0.2200 7.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 1.7460 7.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 0.1970 7.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.7120 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.6310 5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 1.1050 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 1.0490 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 2.5980 5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 1.6800 4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END