IFLAB-ZINC05258684 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.0320 1.5460 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.0160 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.4980 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.0280 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.5430 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -4.0720 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -6.0350 3.6800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3450 -6.4230 3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -6.5190 5.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -6.1320 5.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -5.5280 5.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -6.4570 7.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -6.0150 7.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -5.9150 7.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -5.4790 8.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -5.1410 9.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -5.2390 10.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -5.6810 9.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -4.9080 11.3550 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -6.5270 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -5.7360 2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 1.9160 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.9120 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.9000 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.3540 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.3380 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -0.1280 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.1450 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.3980 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -2.3820 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -2.1730 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -2.1890 3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -4.4420 2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -4.4260 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -7.6040 5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -6.0600 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -6.9980 7.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -6.1780 6.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -5.4010 7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -4.7990 10.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -5.7620 9.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -4.5660 3.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -4.1850 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -7.8450 2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -8.1120 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 41 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M END