IBS-ZINC04029167 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 4.1690 -0.0010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -1.5750 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -2.6610 -2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.8500 -2.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.8240 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -1.0550 -4.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -2.7500 -4.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0990 -3.7340 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -2.1740 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.5200 -5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.3580 -6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -2.8630 -5.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -3.3450 -6.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -3.7330 -5.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -3.3970 -7.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -3.9270 -7.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -3.9080 -9.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -2.7970 -10.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -2.7790 -11.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -3.8710 -12.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -4.9820 -11.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 -5.0020 -10.1270 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 2.6600 -2.4650 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.6600 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -1.0950 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -3.5450 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -1.8160 -5.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.9530 -7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -1.3080 -6.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -3.3150 -7.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 -4.9520 -7.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7900 -1.9440 -9.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -1.9120 -12.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -3.8560 -13.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -5.8350 -12.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -5.8710 -9.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -0.9250 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -1.3660 -0.9930 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