IBS-ZINC06623755 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0640 1.4360 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.0700 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -0.6660 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -0.7560 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.2210 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3580 -2.5780 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -2.7480 -0.5900 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3460 -2.3510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -4.2780 -0.5120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7030 -4.6760 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -4.7060 0.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1420 -4.3410 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -4.1580 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.7300 1.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8550 -2.3390 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.2890 1.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.5670 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.1680 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -2.4500 5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -3.1340 5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -3.5330 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -3.2450 4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -3.4200 7.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -4.1460 7.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -4.2800 9.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -4.8920 9.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -4.3010 8.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -4.1650 7.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -5.9640 10.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -6.3860 11.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -6.6400 10.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -6.2330 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -6.6370 2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -4.7760 -0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -2.3370 -1.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.8100 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.7930 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 1.7960 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -0.2800 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -1.6360 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -2.1400 5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -4.0640 5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -3.5520 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -3.5950 7.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -5.1370 7.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -3.2950 9.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -4.9150 9.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -3.3170 9.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -4.9490 9.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -5.1560 6.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -3.6290 6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -6.0690 9.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -6.6920 11.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -7.6480 10.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -6.6540 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -6.5920 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -7.5950 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -5.7400 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -2.6370 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 35 59 1 0 0 0 0 M END