IBS-ZINC04856440 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8360 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.3790 -4.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2510 1.4360 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 0.0730 -4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 0.9950 -5.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 1.8120 -5.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 0.0500 -5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3120 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.6840 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.9830 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 0.2230 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -0.9610 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.5870 -6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -1.0230 -5.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 1.4320 -5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 0.9070 -5.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 0.4540 -5.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 0.2470 -6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 1.5190 -6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 29 1 0 0 0 0 27 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 M END