IBS-ZINC06645431 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0220 -0.6650 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7500 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.9110 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 0.0530 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -0.0930 -3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -1.1960 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -2.1750 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -2.0320 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -3.2150 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -3.7310 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -4.9420 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -5.6270 0.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -5.1780 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -3.9700 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -3.3650 -1.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -3.9720 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -3.4560 -2.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 -5.2550 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -5.8790 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -7.0910 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -7.7060 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -7.1180 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 -5.8870 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6910 -5.3210 -1.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 -5.6740 -3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1170 -7.7350 -0.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 -8.9810 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 1.1460 -2.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1300 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.7450 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.1910 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -1.7340 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 0.6630 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -1.3000 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -3.1990 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -5.3440 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -7.5560 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -8.6510 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8150 -5.3880 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -6.7510 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5790 -5.1540 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 -9.6960 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1250 -8.8330 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2810 -9.3650 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.0310 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END