IBS-ZINC00498658 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 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 -1.1970 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.0360 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6730 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -1.8930 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.5050 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 0.0740 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 0.3370 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 1.7270 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 2.5060 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0040 1.9100 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1190 0.5320 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -0.2570 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.8300 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -4.1770 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -4.4420 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -3.2620 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -2.3550 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -5.7810 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -5.9070 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -7.1590 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -8.2920 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -8.1780 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -6.9280 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -6.8160 -0.0210 F 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 -2.5560 -3.7510 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -2.3540 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 2.1930 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 3.5830 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8930 2.5240 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0960 0.0720 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -1.3340 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -5.0240 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -7.2570 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -9.2700 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -9.0650 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 15 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 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 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 20 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 M END