IBS-ZINC04029168 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3470 -1.4700 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -1.7910 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -1.3620 -2.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 0.3350 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 0.4440 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -0.5210 -4.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 1.7660 -4.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1550 2.5760 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 1.9730 -4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 2.6460 -5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 1.9410 -6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 1.7700 -5.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 1.6380 -5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 1.5000 -4.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 1.6580 -7.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 1.5100 -7.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 1.5560 -8.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 0.3890 -9.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 0.4320 -10.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 1.6410 -11.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 2.8080 -10.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 2.7650 -9.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 1.1060 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 2.6320 -3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 1.0170 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 3.7190 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 2.4430 -6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 2.5660 -7.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 0.9720 -6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 0.5540 -6.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 2.3210 -6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.5560 -9.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -0.4800 -11.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 1.6740 -12.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 3.7520 -11.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 3.6760 -8.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 -3.0170 -0.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -3.5190 -0.9910 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 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 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 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 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END