!FORMAT=XDS_ASCII MERGE=TRUE FRIEDEL'S_LAW=TRUE !DATE= 6-Jul-2006 !GENERATED BY: XSCALE (VERSION June 2006) !OUTPUT_FILE=ccd.hkl !COMPRISES THE FOLLOWING SCALED INPUT FILES: ! ISET= 1 INPUT_FILE=XDS_ASCII.HKL ! ISET= 1 X-RAY_WAVELENGTH= 0.97940 (<0 if unknown) ! !SPACE_GROUP_NUMBER= 19 !UNIT_CELL_CONSTANTS= 54.37 58.24 66.71 90.000 90.000 90.000 !NUMBER_OF_ITEMS_IN_EACH_DATA_RECORD= 5 !ITEM_H=1 !ITEM_K=2 !ITEM_L=3 !ITEM_IOBS=4 !ITEM_SIGMA(IOBS)=5 !END_OF_HEADER 0 0 6 5.752E+05 2.187E+04 0 0 8 8.461E+03 4.031E+02 0 0 10 1.930E+05 7.271E+03 0 0 12 5.128E+04 2.029E+03 0 0 14 7.165E+04 2.815E+03 0 0 16 1.686E+03 5.301E+02 0 0 18 2.146E+06 8.214E+04 0 0 20 3.078E+04 1.473E+03 0 0 22 9.274E+05 3.464E+04 0 0 24 1.083E+05 4.362E+03 0 0 26 2.627E+05 9.963E+03 0 0 28 3.721E+05 1.385E+04 0 0 30 4.145E+04 2.156E+03 0 0 32 1.244E+05 4.984E+03 0 0 34 5.480E+04 2.462E+03 0 0 36 3.146E+03 9.636E+02 0 1 1 1.309E+01 1.690E+01 0 1 3 2.127E+05 5.580E+03 0 1 4 4.275E+04 1.124E+03 0 1 5 1.835E+03 1.109E+02 0 1 6 4.297E+05 1.133E+04 0 1 7 4.361E+04 1.163E+03 0 1 8 1.495E+05 3.933E+03 0 1 9 1.630E+04 4.986E+02 0 1 10 9.116E+04 2.418E+03 0 1 11 1.069E+05 4.071E+03 0 1 12 1.819E+05 6.876E+03 0 1 13 1.981E+05 7.565E+03 0 1 14 3.847E+04 1.585E+03 0 1 15 1.039E+05 2.835E+03 0 1 16 3.799E+05 1.003E+04 0 1 17 3.751E+03 3.508E+02 0 1 18 1.097E+03 3.430E+02 0 1 19 3.412E+05 8.963E+03 0 1 20 2.397E+04 8.603E+02 0 1 21 3.539E+05 9.378E+03 0 1 22 6.911E+02 3.876E+02 0 1 23 3.867E+04 1.246E+03 0 1 24 8.267E+02 5.019E+02 0 1 25 2.324E+05 6.196E+03 0 1 26 5.864E+04 1.805E+03 0 1 27 6.202E+03 6.138E+02 0 1 28 4.917E+03 6.114E+02 0 1 29 5.863E+04 1.827E+03 0 1 30 1.424E+04 8.447E+02 0 1 31 1.044E+05 3.018E+03 0 1 32 2.592E+04 1.136E+03 0 1 33 3.281E+04 1.263E+03 0 1 34 2.898E+03 6.151E+02 0 1 35 -8.581E+02 7.485E+02 0 1 36 1.115E+04 8.602E+02 0 1 37 1.326E+03 8.752E+02 0 2 0 4.922E+05 2.303E+04 0 2 1 4.907E+04 1.272E+03 0 2 2 5.726E+04 1.060E+03 0 2 4 2.501E+04 6.779E+02 0 2 5 1.475E+04 4.221E+02 0 2 6 1.312E+04 3.914E+02 0 2 7 6.411E+04 1.729E+03 0 2 8 3.556E+04 9.977E+02 0 2 9 2.594E+03 1.689E+02 0 2 10 5.016E+04 1.368E+03 0 2 11 4.218E+04 1.207E+03 0 2 12 6.468E+04 1.798E+03 0 2 13 1.003E+04 3.881E+02 0 2 14 1.125E+04 4.468E+02 0 2 15 8.551E+05 2.306E+04 0 2 16 1.276E+06 4.748E+04 0 2 17 5.561E+04 2.291E+03 0 2 18 8.862E+04 3.487E+03 0 2 19 5.043E+04 2.086E+03 0 2 20 1.237E+05 3.403E+03 0 2 21 3.206E+05 8.422E+03 0 2 22 3.132E+04 1.032E+03 0 2 23 5.221E+04 1.542E+03 0 2 24 6.525E+04 1.966E+03 0 2 25 1.375E+04 6.912E+02 0 2 26 4.979E+04 1.592E+03 0 2 27 4.525E+04 1.473E+03 0 2 28 3.208E+05 8.505E+03 0 2 29 6.412E+04 2.055E+03 0 2 30 4.731E+03 5.684E+02 0 2 31 9.753E+04 2.815E+03 0 2 32 3.570E+04 1.368E+03 0 2 33 5.454E+04 1.788E+03 0 2 34 4.349E+04 1.530E+03 0 2 35 3.711E+04 1.385E+03 0 2 36 1.584E+03 7.914E+02 0 3 1 1.459E+05 2.676E+03 0 3 2 1.803E+04 3.448E+02 0 3 3 4.453E+02 4.805E+01 0 3 4 7.545E+04 1.988E+03 0 3 5 4.028E+05 1.054E+04 0 3 6 7.452E+05 1.942E+04 0 3 7 5.482E+04 1.476E+03 0 3 8 3.195E+05 8.389E+03 0 3 9 3.721E+03 2.238E+02 0 3 10 8.139E+04 2.185E+03 0 3 11 6.625E+04 1.801E+03 0 3 12 2.585E+05 6.825E+03 0 3 13 1.087E+03 2.272E+02 0 3 14 1.107E+05 3.069E+03 0 3 15 6.386E+04 1.789E+03 0 3 16 1.313E+06 3.523E+04 0 3 17 3.351E+04 1.010E+03 0 3 18 1.141E+04 4.867E+02 0 3 19 2.000E+05 5.317E+03 0 3 20 3.945E+04 1.771E+03 0 3 21 1.558E+04 9.243E+02 0 3 22 3.401E+04 1.511E+03 0 3 23 3.842E+04 1.711E+03 0 3 24 1.478E+03 4.068E+02 0 3 25 1.675E+05 4.535E+03 0 3 26 2.347E+04 1.029E+03 0 3 27 1.823E+05 4.904E+03 0 3 28 1.330E+04 7.152E+02 0 3 29 9.584E+04 2.750E+03 0 3 30 6.130E+04 1.937E+03 0 3 31 2.316E+04 1.109E+03 0 3 32 2.542E+05 6.798E+03 0 3 33 3.888E+03 5.950E+02 0 3 34 3.293E+04 1.298E+03 0 3 35 -5.123E+02 6.517E+02 0 3 36 1.168E+04 9.755E+02 0 4 1 8.563E+04 1.578E+03 0 4 2 4.257E+05 7.902E+03 0 4 3 2.182E+04 4.247E+02 0 4 4 1.187E+05 2.196E+03 0 4 5 4.519E+04 9.825E+02 0 4 6 1.451E+04 4.316E+02 0 4 7 8.732E+04 2.305E+03 0 4 8 1.781E+04 5.487E+02 0 4 9 1.033E+05 2.734E+03 0 4 10 9.614E+02 1.659E+02 0 4 11 2.412E+05 6.414E+03 0 4 12 1.024E+05 2.783E+03 0 4 13 1.468E+04 5.397E+02 0 4 14 3.604E+02 2.157E+02 0 4 15 4.890E+04 1.384E+03 0 4 16 1.227E+03 3.067E+02 0 4 17 2.619E+02 3.421E+02 0 4 18 2.078E+04 7.288E+02 0 4 19 4.269E+04 1.327E+03 0 4 20 2.185E+05 5.769E+03 0 4 21 3.329E+04 1.071E+03 0 4 22 2.064E+04 7.753E+02 0 4 23 2.510E+05 9.410E+03 0 4 24 3.612E+04 1.628E+03 0 4 25 5.213E+03 7.642E+02 0 4 26 6.084E+04 2.525E+03 0 4 27 2.301E+05 6.191E+03 0 4 28 6.400E+04 1.971E+03 0 4 29 2.058E+04 9.394E+02 0 4 30 1.040E+03 5.453E+02 0 4 31 2.491E+05 6.725E+03 0 4 32 3.085E+03 7.216E+02 0 4 33 1.054E+03 5.777E+02 0 4 34 6.455E+04 2.033E+03 0 4 35 5.548E+03 7.821E+02 0 4 36 4.721E+02 7.269E+02 0 5 1 6.677E+04 1.245E+03 0 5 2 1.316E+04 2.684E+02 0 5 3 1.316E+05 2.423E+03 0 5 4 2.283E+04 4.556E+02 0 5 5 8.550E+05 2.236E+04 0 5 6 5.157E+04 1.136E+03 0 5 7 7.876E+04 2.086E+03 0 5 8 1.403E+05 3.679E+03 0 5 9 6.158E+04 1.634E+03 0 5 10 1.331E+04 4.604E+02 0 5 11 5.700E+04 1.540E+03 0 5 12 2.669E+05 7.091E+03 0 5 13 7.380E+05 1.960E+04 0 5 14 1.085E+05 2.910E+03 0 5 15 1.578E+06 4.183E+04 0 5 16 1.621E+05 4.338E+03 0 5 17 7.403E+05 1.949E+04 0 5 18 6.306E+04 1.801E+03 0 5 19 7.000E+03 4.448E+02 0 5 20 9.445E+04 2.649E+03 0 5 21 6.724E+04 1.927E+03 0 5 22 2.238E+05 5.944E+03 0 5 23 5.559E+04 1.644E+03 0 5 24 8.080E+03 5.620E+02 0 5 25 1.996E+03 4.307E+02 0 5 26 2.514E+03 7.505E+02 0 5 27 1.803E+04 1.262E+03 0 5 28 5.273E+04 2.443E+03 0 5 29 2.479E+05 9.356E+03 0 5 30 1.558E+04 7.582E+02 0 5 31 1.812E+05 4.901E+03 0 5 32 5.894E+04 1.865E+03 0 5 33 1.817E+04 9.013E+02 0 5 34 5.261E+04 1.750E+03 0 5 35 8.210E+03 8.112E+02 0 5 36 4.227E+04 1.584E+03 0 6 0 2.944E+05 7.734E+03 0 6 1 4.505E+04 8.535E+02 0 6 2 4.192E+05 7.732E+03 0 6 3 2.581E+05 4.761E+03 0 6 4 3.537E+02 8.052E+01 0 6 5 4.350E+04 8.442E+02 0 6 6 6.034E+04 1.146E+03 0 6 7 5.623E+04 1.244E+03 0 6 8 7.812E+03 2.469E+02 0 6 9 2.652E+04 7.737E+02 0 6 10 1.081E+05 2.889E+03 0 6 11 5.007E+03 2.942E+02 0 6 12 7.462E+03 3.895E+02 0 6 13 2.063E+05 5.475E+03 0 6 14 7.272E+04 2.017E+03 0 6 15 4.556E+03 3.830E+02 0 6 16 1.613E+05 4.302E+03 0 6 17 4.836E+04 1.427E+03 0 6 18 2.552E+05 6.712E+03 0 6 19 6.405E+04 1.855E+03 0 6 20 1.461E+04 6.759E+02 0 6 21 6.859E+04 1.969E+03 0 6 22 3.925E+03 4.655E+02 0 6 23 7.772E+04 2.221E+03 0 6 24 6.582E+03 4.684E+02 0 6 25 3.527E+04 1.149E+03 0 6 26 1.005E+05 2.819E+03 0 6 27 3.824E+04 1.225E+03 0 6 28 9.393E+04 3.846E+03 0 6 29 8.490E+02 7.220E+02 0 6 30 1.477E+04 1.165E+03 0 6 31 4.369E+04 2.196E+03 0 6 32 3.541E+02 7.845E+02 0 6 33 2.930E+03 6.766E+02 0 6 34 4.065E+03 6.540E+02 0 6 35 3.022E+02 6.437E+02 0 6 36 1.084E+04 9.619E+02 0 7 1 4.103E+03 1.284E+02 0 7 2 5.917E+05 1.101E+04 0 7 3 5.961E+03 1.666E+02 0 7 4 2.132E+03 1.161E+02 0 7 5 2.220E+05 4.103E+03 0 7 6 3.252E+05 6.029E+03 0 7 7 1.633E+05 3.020E+03 0 7 8 6.675E+04 1.465E+03 0 7 9 1.607E+05 3.450E+03 0 7 10 3.679E+04 8.579E+02 0 7 11 5.837E+04 2.226E+03 0 7 12 5.189E+03 3.953E+02 0 7 13 5.243E+05 1.390E+04 0 7 14 1.974E+04 6.775E+02 0 7 15 1.161E+03 3.147E+02 0 7 16 2.504E+05 6.623E+03 0 7 17 6.289E+05 1.653E+04 0 7 18 5.402E+04 1.587E+03 0 7 19 7.145E+05 1.873E+04 0 7 20 8.749E+04 2.442E+03 0 7 21 5.927E+04 1.712E+03 0 7 22 3.061E+05 8.097E+03 0 7 23 5.192E+03 4.878E+02 0 7 24 8.822E+02 3.814E+02 0 7 25 5.168E+03 5.620E+02 0 7 26 1.012E+05 2.926E+03 0 7 27 1.607E+04 7.072E+02 0 7 28 2.016E+03 4.430E+02 0 7 29 3.259E+05 8.592E+03 0 7 30 2.540E+04 1.367E+03 0 7 31 1.553E+04 1.118E+03 0 7 32 4.994E+04 2.251E+03 0 7 33 1.130E+05 4.569E+03 0 7 34 -3.626E+02 7.771E+02 0 7 35 1.033E+03 6.002E+02 0 7 36 1.079E+04 8.284E+02 0 8 0 4.492E+04 1.219E+03 0 8 1 9.966E+04 1.854E+03 0 8 2 2.452E+04 4.915E+02 0 8 3 3.176E+05 5.871E+03 0 8 4 1.683E+05 3.101E+03 0 8 5 5.942E+04 1.130E+03 0 8 6 3.798E+04 7.575E+02 0 8 7 5.824E+01 1.225E+02 0 8 8 1.812E+05 3.370E+03 0 8 9 5.515E+02 1.580E+02 0 8 10 1.989E+05 5.223E+03 0 8 11 7.056E+03 5.825E+02 0 8 12 4.074E+05 8.752E+03 0 8 13 1.220E+04 4.788E+02 0 8 14 1.114E+04 4.550E+02 0 8 15 4.808E+05 1.256E+04 0 8 16 7.374E+04 2.083E+03 0 8 17 1.645E+05 4.390E+03 0 8 18 1.287E+05 3.463E+03 0 8 19 3.644E+04 1.199E+03 0 8 20 2.854E+05 7.525E+03 0 8 21 2.228E+04 8.365E+02 0 8 22 1.406E+04 6.882E+02 0 8 23 7.894E+04 2.304E+03 0 8 24 8.835E+03 5.943E+02 0 8 25 1.721E+05 4.626E+03 0 8 26 1.156E+05 3.186E+03 0 8 27 1.642E+04 8.386E+02 0 8 28 4.873E+04 1.576E+03 0 8 29 9.862E+04 2.758E+03 0 8 30 1.511E+04 7.687E+02 0 8 31 3.629E+03 5.699E+02 0 8 32 6.124E+03 8.559E+02 0 8 33 4.378E+04 2.162E+03 0 8 34 1.224E+04 1.251E+03 0 8 35 1.836E+03 7.643E+02 0 9 1 1.478E+05 2.745E+03 0 9 2 6.168E+05 1.151E+04 0 9 3 2.010E+05 3.731E+03 0 9 4 1.367E+05 2.543E+03 0 9 5 9.554E+04 1.809E+03 0 9 6 2.122E+04 4.637E+02 0 9 7 2.694E+05 5.009E+03 0 9 8 2.105E+05 3.919E+03 0 9 9 4.000E+03 2.600E+02 0 9 10 6.776E+04 2.665E+03 0 9 11 9.692E+02 2.099E+02 0 9 12 2.746E+05 5.892E+03 0 9 13 6.921E+05 1.479E+04 0 9 14 2.095E+04 5.716E+02 0 9 15 5.042E+04 1.447E+03 0 9 16 9.543E+04 2.647E+03 0 9 17 4.422E+04 1.343E+03 0 9 18 1.444E+03 3.932E+02 0 9 19 1.583E+03 4.054E+02 0 9 20 4.515E+04 1.414E+03 0 9 21 2.350E+04 8.403E+02 0 9 22 2.722E+02 3.837E+02 0 9 23 3.783E+03 4.327E+02 0 9 24 2.600E+04 9.138E+02 0 9 25 1.321E+04 7.446E+02 0 9 26 1.489E+04 7.339E+02 0 9 27 4.838E+04 1.474E+03 0 9 28 7.192E+04 2.136E+03 0 9 29 7.939E+04 2.343E+03 0 9 30 5.460E+04 1.735E+03 0 9 31 1.059E+05 3.024E+03 0 9 32 8.662E+03 7.265E+02 0 9 33 3.340E+04 1.269E+03 0 9 34 -2.003E+02 9.733E+02 0 9 35 1.095E+04 1.291E+03 0 10 0 3.398E+05 8.870E+03 0 10 1 4.184E+05 7.790E+03 0 10 2 1.973E+01 1.107E+02 0 10 3 1.055E+04 3.125E+02 0 10 4 2.437E+05 4.528E+03 0 10 5 1.360E+05 2.553E+03 0 10 6 1.959E+04 4.418E+02 0 10 7 4.614E+05 8.749E+03 0 10 8 3.466E+05 6.483E+03 0 10 9 2.757E+05 5.169E+03 0 10 10 2.534E+04 6.568E+02 0 10 11 9.580E+05 2.077E+04 0 10 12 5.399E+04 1.276E+03 0 10 13 4.869E+02 2.535E+02 0 10 14 2.532E+05 5.429E+03 0 10 15 4.131E+04 1.006E+03 0 10 16 5.661E+03 3.869E+02 0 10 17 3.649E+03 4.446E+02 0 10 18 1.295E+04 6.096E+02 0 10 19 2.132E+03 4.584E+02 0 10 20 3.823E+04 1.236E+03 0 10 21 6.473E+04 1.897E+03 0 10 22 3.356E+05 8.820E+03 0 10 23 4.779E+04 1.447E+03 0 10 24 1.465E+04 7.103E+02 0 10 25 1.638E+05 4.412E+03 0 10 26 9.641E+04 2.743E+03 0 10 27 1.067E+05 2.995E+03 0 10 28 7.576E+04 2.169E+03 0 10 29 4.512E+04 1.488E+03 0 10 30 1.242E+05 3.504E+03 0 10 31 7.708E+04 2.278E+03 0 10 32 1.127E+04 6.912E+02 0 10 33 7.784E+04 2.347E+03 0 10 34 4.159E+04 1.489E+03 0 10 35 2.275E+04 1.052E+03 0 11 1 1.587E+05 2.965E+03 0 11 2 5.083E+04 9.945E+02 0 11 3 1.905E+05 3.570E+03 0 11 4 7.112E+04 1.373E+03 0 11 5 1.319E+05 3.551E+03 0 11 6 5.090E+03 2.175E+02 0 11 7 1.395E+05 2.672E+03 0 11 8 8.720E+05 1.636E+04 0 11 9 5.192E+05 9.666E+03 0 11 10 3.803E+05 7.042E+03 0 11 11 1.735E+06 3.750E+04 0 11 12 2.090E+04 5.867E+02 0 11 13 5.460E+04 1.290E+03 0 11 14 8.592E+03 3.762E+02 0 11 15 6.652E+03 4.076E+02 0 11 16 4.084E+04 1.093E+03 0 11 17 7.816E+04 1.802E+03 0 11 18 3.480E+04 9.113E+02 0 11 19 4.833E+04 1.425E+03 0 11 20 1.094E+04 5.438E+02 0 11 21 2.581E+03 4.396E+02 0 11 22 6.974E+02 4.243E+02 0 11 23 1.796E+04 8.132E+02 0 11 24 9.711E+03 5.822E+02 0 11 25 1.565E+04 7.783E+02 0 11 26 4.732E+03 5.576E+02 0 11 27 1.022E+05 2.886E+03 0 11 28 4.806E+02 4.828E+02 0 11 29 1.062E+05 3.036E+03 0 11 30 5.565E+04 1.794E+03 0 11 31 1.031E+04 7.193E+02 0 11 32 8.595E+03 6.899E+02 0 11 33 5.730E+04 1.853E+03 0 11 34 4.632E+03 8.160E+02 0 11 35 1.213E+03 1.035E+03 0 12 0 1.060E+06 2.814E+04 0 12 1 2.594E+05 4.980E+03 0 12 2 8.425E+03 2.707E+02 0 12 3 4.584E+04 9.374E+02 0 12 4 4.089E+05 1.072E+04 0 12 5 6.967E+04 1.333E+03 0 12 6 1.263E+03 1.755E+02 0 12 7 1.849E+05 3.466E+03 0 12 8 4.494E+04 9.077E+02 0 12 9 1.132E+03 1.975E+02 0 12 10 1.187E+06 2.204E+04 0 12 11 8.687E+03 4.140E+02 0 12 12 4.284E+04 1.029E+03 0 12 13 -8.359E+01 2.965E+02 0 12 14 6.810E+05 1.449E+04 0 12 15 2.189E+04 6.988E+02 0 12 16 1.776E+04 6.318E+02 0 12 17 1.249E+03 3.529E+02 0 12 18 5.109E+02 3.460E+02 0 12 19 7.243E+04 1.716E+03 0 12 20 1.170E+03 3.258E+02 0 12 21 6.393E+02 3.789E+02 0 12 22 4.248E+04 1.342E+03 0 12 23 1.043E+04 5.951E+02 0 12 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