CHEMBRIDGE-ZINC01177123 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 0.1340 1.1070 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.4090 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.7500 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.9040 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -1.8290 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -2.2850 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -1.8130 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -0.8850 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -0.4370 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -2.2590 0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -1.7300 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 -2.3360 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -3.1410 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4160 -1.9830 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7170 -2.4590 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5340 -2.7200 2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8320 -3.1950 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3080 -3.4070 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4850 -3.1440 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1890 -2.6640 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9840 -3.3670 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2660 -3.1370 -2.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7010 -3.4730 3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2850 -3.2880 4.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.4650 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 1.3500 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 1.5870 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.8890 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.2700 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.8300 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -0.3920 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.1960 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -3.0070 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 -0.5160 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 0.2820 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -1.9710 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -0.6480 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2230 -1.3980 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1640 -2.5550 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3110 -3.7750 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5520 -2.4560 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2360 -3.8250 -1.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9530 -3.9320 3.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.4830 -4.0990 4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5180 -3.9560 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 42 45 1 0 0 0 0 43 44 1 0 0 0 0 M END