IBS-ZINC04527969 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6800 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 0.0140 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -0.6740 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -0.0040 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4290 -0.6850 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5850 0.0090 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5650 1.2250 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 -0.7060 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1320 -0.1400 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0260 -1.2260 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3100 -2.3300 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0550 -2.0600 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3430 -2.7190 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5080 -1.1410 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1380 0.0970 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5160 0.1750 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2780 -0.9770 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6530 -2.2190 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2720 -2.3010 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6140 -3.1830 -0.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8320 -2.5630 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6300 -1.1660 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9930 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -1.7600 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 1.0940 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -1.7540 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 -1.6540 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3790 0.9120 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5470 0.9970 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0020 1.1360 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7870 -3.2620 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9660 -2.7210 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6870 -2.9460 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END