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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R040127
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.034
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.4460 8.488931   1  1  0    2   10.4566  8.480344    0.0106  0.008587
   17.4236 5.095338   1  3  0    2   17.4196  5.096488   -0.0040 -0.001150
   19.7237 4.505005   0  4  0    2   19.7068  4.508835   -0.0169 -0.003830
   26.0751 3.418866   1  3  1    2   26.0738  3.419035   -0.0013 -0.000169
   27.1449 3.286338   2  4  0    2   27.1329  3.287761   -0.0120 -0.001423
   28.3084 3.153694   3  1  0    2   28.3092  3.153603    0.0008  0.000092
   29.9411 2.985141   2  2  1    2   29.9425  2.985000    0.0014  0.000141
   31.6525 2.827362   3  3  0    2   31.6592  2.826781    0.0067  0.000580
   32.8799 2.724458   1  5  1    2   32.8814  2.724340    0.0015  0.000117
   34.5227 2.598352   0  6  1    2   34.5274  2.598011    0.0047  0.000340
   38.5244 2.336918  -3  5  1    2   38.5252  2.336869    0.0008  0.000049
   39.5966 2.276020  -3  1  2    2   39.6004  2.275809    0.0038  0.000211
   41.4333 2.179188   2  6  1    2   41.4366  2.179020    0.0033  0.000168
   43.5472 2.078095   2  0  2    2   43.5412  2.078367   -0.0060 -0.000271
   44.4151 2.039450   3  5  1    2   44.4238  2.039073    0.0087  0.000378
   48.4368 1.878974  -4  6  1    2   48.4316  1.879163   -0.0052 -0.000189
   55.0660 1.667280   4  6  1    2   55.0638  1.667341   -0.0022 -0.000061

 rmse = 0.00005330810
 
     A =     9.891(1)          B =    18.035(3)           C =     5.3173(8)      
 Alpha =    90.             Beta =   103.732(8)       Gamma =    90.             
 
 Volume =    921.4(1)