IFLAB-ZINC05143434 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -2.6740 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0340 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -2.8310 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.1970 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -2.8730 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -4.2680 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -4.9000 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.1560 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -6.2620 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -6.4580 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -7.5440 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -5.2700 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -5.1400 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -7.2680 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -7.7560 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -8.7470 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -9.2560 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -8.7730 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -7.7840 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -7.3160 2.3030 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -2.1590 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -2.7880 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -0.8120 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 0.0320 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -2.4250 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -3.7530 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -7.3600 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -9.1260 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -10.0300 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -9.1720 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -0.3100 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -0.3440 -0.0560 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 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 41 1 0 0 0 0 29 42 1 0 0 0 0 M END