IFLAB-ZINC04160161 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2060 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 2.1580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 1.5210 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 2.2350 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 1.5630 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 2.2680 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3320 3.2380 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5300 1.6120 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5830 2.2280 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5220 0.2060 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -0.4470 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 0.2440 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.7350 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -2.1120 -0.0420 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -0.3860 -1.1840 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -0.3980 1.1000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7660 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 3.2380 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 3.2050 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 -0.3490 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 -1.5270 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 M END