IBS-ZINC05389418 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8010 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -2.5480 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3610 -2.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9610 -2.0270 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -1.8690 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -2.3280 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -1.5300 -5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -1.9480 -6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -3.1690 -6.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 -3.9670 -5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -3.5420 -3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -3.5820 -7.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -3.8250 -2.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -4.5040 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -3.9040 -3.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -6.0100 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -6.5280 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -8.0330 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -8.8760 -4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -10.1700 -3.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -10.9550 -4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -10.1920 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -8.8540 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -8.5680 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -9.5890 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -10.9100 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -11.2160 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -0.7800 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -2.2770 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -0.5800 -4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -1.3250 -7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -4.9180 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -4.1610 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -3.3060 -7.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -4.3040 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -6.4070 -3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -6.3330 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -6.1300 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -6.2040 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -8.5770 -5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -7.5420 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -9.3660 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -11.7070 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -12.2470 -2.1020 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END