IFLAB-ZINC04583960 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -2.4980 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -2.4510 -0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -3.4490 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -4.1800 -2.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -5.0890 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -5.2750 -4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -6.1680 -5.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -6.9100 -5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -6.7900 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -5.8620 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -5.7280 -2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -7.8970 -6.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -8.0750 -9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -7.2700 -10.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -5.7000 -9.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -6.5040 -8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -5.8770 -11.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -5.4130 -12.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -6.2260 -12.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -5.8000 -13.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -4.5610 -12.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -3.7480 -12.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -4.1720 -11.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -1.7370 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -2.8850 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -4.1430 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -4.6960 -4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -7.3940 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -8.5720 -6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -8.4730 -6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 -8.5500 -8.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -8.8400 -9.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -7.9410 -11.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 -6.5230 -10.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -4.9340 -9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -5.2250 -9.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -7.2520 -8.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -5.8340 -7.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -5.0140 -11.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -6.5400 -12.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -7.1940 -13.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -6.4360 -13.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -4.2290 -13.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.7800 -11.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.5350 -11.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -7.1740 -7.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -6.6010 -10.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 55 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 56 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 56 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 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 M END