IBS-ZINC05156295 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1100 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.5220 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -1.9130 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -2.6710 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.0190 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -4.0040 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -4.7440 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -4.1370 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 -2.8910 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -2.6050 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -1.4530 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -3.7320 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5080 -4.2310 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8940 -3.6000 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2420 -2.8270 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1660 -1.7680 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -2.4520 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6010 -2.1440 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9990 -1.4850 -1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7320 -2.1890 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0970 -1.5850 -4.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7300 -0.2760 -4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9990 0.4290 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6370 -0.1740 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 1.1890 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 0.0590 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -2.5920 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -5.0770 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 -4.3400 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -4.3500 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2510 -4.7710 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5160 -4.9230 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6340 -4.3840 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8910 -2.9190 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2840 -3.5150 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3860 -1.2420 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1510 -1.0570 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 -3.1520 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0300 -1.7000 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3490 -2.8870 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5320 -1.3900 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0180 -3.2120 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6690 -2.1360 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0150 0.1960 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7120 1.4510 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0680 0.3780 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5140 -3.1780 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 53 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 21 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END