OTAVA-ZINC01056872 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 0.0120 1.4080 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.0420 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -0.6320 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 0.0670 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.4330 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 2.1280 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 3.5410 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 4.3680 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 5.6540 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 5.6020 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 4.3030 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 6.6890 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 6.4860 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 7.5150 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 8.7060 -0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 7.0220 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 5.7230 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 4.9900 -0.0630 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 5.0630 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 5.7810 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8210 5.2490 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9970 5.9610 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9960 7.2040 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8150 7.7360 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 7.0260 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1490 7.8990 0.5530 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.1080 0.3050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1480 -2.7770 0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -2.7530 0.2970 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9340 1.9300 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -0.5120 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -0.4680 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 1.9760 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 4.0370 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 6.5380 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 7.6890 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 4.0930 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 4.2800 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 5.5490 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8180 8.7050 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 7.4390 1.2040 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 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 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END