IBS-ZINC04090385 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 0 0 1 0 0 0 0 0999 V2000 0.7990 -0.3780 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.5170 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5250 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.0550 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7640 -2.4080 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.5660 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -3.2700 0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.5480 1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -3.7660 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.4540 0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -4.2730 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -4.3200 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -5.6700 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -6.1850 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -5.2360 4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -5.1890 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -3.8390 4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -3.3240 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -5.7510 5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -4.9110 6.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -5.1770 7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -6.1130 8.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -4.3130 7.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4770 -3.2690 7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 -4.7300 7.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 -4.6090 6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1400 -3.8530 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 -6.1960 7.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.0080 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -1.4630 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.0690 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.4530 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.8780 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.9700 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.7880 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.1710 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.1590 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -1.9970 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -6.3460 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -5.6230 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -6.2320 4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -7.1800 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -3.8860 5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -3.1630 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -3.2770 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.3290 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -5.7140 6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -6.7790 5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -4.1620 5.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -3.9750 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 -4.1500 7.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9210 -2.8090 7.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -6.3180 8.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -6.8210 7.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 -6.4930 6.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -5.4380 9.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -2.2390 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -4.4770 9.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -3.8600 9.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -2.5910 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 58 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 59 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 57 59 1 0 0 0 0 58 61 1 0 0 0 0 59 60 1 0 0 0 0 M END