IFLAB-ZINC04272575 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.5040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.0020 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.6860 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0670 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.7690 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.0790 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.6980 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1680 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -4.9920 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -6.4080 -0.7370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4970 -6.5520 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -6.3950 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -4.9300 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.5040 2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -7.4350 -1.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -8.6680 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -8.9020 -1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -9.6420 -2.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -10.9600 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -11.3130 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -11.2040 -4.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -9.8260 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -9.4110 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -11.6750 -5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -11.6580 -6.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -12.1240 -7.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -12.6060 -8.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -12.6230 -7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -12.1640 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -13.0600 -9.6100 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 1.8510 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 1.8720 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 1.8810 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.1400 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.6010 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.6220 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.1610 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -4.6070 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -5.0120 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -6.9520 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -6.8080 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -7.2270 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -11.7100 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -10.9270 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -12.3320 -4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -10.6230 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -9.7680 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -9.1570 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -8.3540 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -10.0080 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -11.2820 -5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -12.1110 -8.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -12.9990 -8.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -12.1810 -5.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 42 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 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END