IBS-ZINC04811315 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7840 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3920 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.3970 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.7330 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.1370 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.1440 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.2000 -0.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0040 -0.7530 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.3430 -2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -2.8740 -1.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -3.0740 -2.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6920 -2.1550 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -4.1500 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -4.2090 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -3.4690 -0.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -4.9890 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -4.9650 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -5.6960 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 -6.4560 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -6.4830 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -5.7590 -1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -7.1750 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 -7.9340 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -3.5520 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -4.1520 -4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -4.5850 -4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -4.4150 -4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -3.8240 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -3.3920 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -2.8920 -1.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.6500 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.1260 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -3.4800 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.1820 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -5.1100 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -3.8540 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -4.3740 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -5.6790 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -7.0740 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -5.7840 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -8.6580 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 -7.2640 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9890 -8.4590 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -4.2830 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -5.0540 -5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -4.7470 -4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -3.6930 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 M END