IFLAB-ZINC04850589 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.2720 1.8320 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 0.4140 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -0.2120 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.5220 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -0.1180 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -1.4880 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -2.2220 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.5860 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -2.3860 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.7400 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -3.5170 1.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -3.9430 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -3.6820 3.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -4.7350 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -4.9960 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -5.1600 3.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -5.9940 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -5.8860 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -6.7060 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6200 -7.6320 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -7.7440 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -6.9250 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 -8.8380 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 -9.2810 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -10.1480 1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 -8.5430 3.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7600 -8.5710 4.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1920 -8.0810 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5710 -6.6870 5.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 2.2050 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 2.2990 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 2.0720 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 1.5920 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 0.4530 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -1.9860 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -3.2920 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -3.3010 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.7960 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.8240 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -3.3300 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -3.7260 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -4.8880 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 -5.1630 5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -7.0020 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -9.6660 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4060 -8.4490 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1320 -9.5890 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5710 -7.9150 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 -8.7820 6.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -8.0510 6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3380 -5.9710 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 -6.3940 6.6590 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END