IBS-ZINC01411114 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -0.6960 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.1470 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -1.3710 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -1.1670 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.7240 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -1.5220 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -1.4890 -5.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -1.8490 -6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -1.3820 -7.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -1.7510 -9.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -2.5850 -9.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -3.0550 -8.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -2.6950 -7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -3.8470 -9.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -4.1880 -10.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -3.0850 -10.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -1.9260 -5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -2.2920 -6.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -1.8140 -4.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -2.0630 -4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 -1.8180 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -1.3900 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -1.1510 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -1.1900 -5.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -3.5230 -5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -0.5100 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -0.5600 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.7340 -7.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -1.3900 -9.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -3.0620 -6.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -5.1180 -10.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -4.2680 -11.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 -1.9950 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -2.0660 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -0.8580 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -0.3570 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -0.1400 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 -1.3520 -5.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -1.4540 -6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -3.6930 -6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -3.7400 -5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -4.1760 -4.4150 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 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 20 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 36 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 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END