IBS-ZINC04863113 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 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 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1410 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4780 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -1.8550 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6270 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0010 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.0990 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -4.6790 3.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -6.0780 3.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -6.6930 4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -7.9880 4.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -8.2310 5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -9.3970 6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -9.3090 7.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -8.0710 8.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -6.9110 7.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -6.9800 6.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -6.0520 5.3670 O 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 1.1630 1.2190 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1180 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -2.3350 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5920 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.6940 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -6.6120 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -10.3630 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -10.2100 7.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -8.0140 8.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -5.9500 7.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 M END