OTAVA-ZINC05374858 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.0160 1.8780 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0670 -0.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -0.3890 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -1.9110 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -2.2960 -0.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7660 -1.8650 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -3.7970 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -4.3790 -1.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -1.7840 -1.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -1.5420 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -1.7470 -0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 -1.0160 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 -0.8360 -2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 0.3160 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 1.2620 -1.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3250 0.3670 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0540 1.4060 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5220 1.3240 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2580 2.1520 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6340 2.0700 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2870 1.1700 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5660 0.3480 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1900 0.4220 -2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8990 -1.2440 -2.2840 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2950 -1.8350 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9190 -3.3890 -3.3600 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 2.2690 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.2760 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 2.1760 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0340 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 0.0660 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -2.2660 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -2.3660 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -1.6210 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -0.0580 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 -1.7260 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 2.2930 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7500 2.8540 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2040 2.7080 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3650 1.1100 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0830 -0.3510 -2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6290 -0.2180 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -4.4860 0.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -5.4470 0.6250 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 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 43 44 1 0 0 0 0 M END