IBS-ZINC05208172 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.3660 -1.1640 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.0200 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.6940 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -0.5760 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -0.2950 1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 -0.7900 -0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -1.1000 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -1.2800 -1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -1.2240 -2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.0460 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -1.1660 -3.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 -1.5670 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -3.0660 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -3.7230 -4.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -5.0970 -4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -5.8150 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -5.1580 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -3.7830 -3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.7470 -2.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.4130 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -0.8040 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -0.4610 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 0.7840 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 1.0990 -4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 0.1700 -3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 -1.0750 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -1.3920 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -1.8000 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.7390 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -0.7940 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 0.5960 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 0.6570 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -0.7160 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -1.1300 -4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 -1.1750 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -3.1620 -4.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -5.6100 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -6.8880 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -5.7180 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7270 -3.2690 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -1.1540 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -0.9570 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 0.6590 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -0.2600 -4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -1.8760 -3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 1.5100 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 2.0720 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2640 0.4170 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -1.8010 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -2.3660 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END