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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R070451
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:    0.006
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   14.6665 6.032262   1  1  0    2   14.6656  6.032646   -0.0009 -0.000384
   18.4160 4.812087   0  0  1    2   18.4200  4.811046    0.0040  0.001041
   23.2083 3.828404   0  2  0    2   23.2113  3.827914    0.0030  0.000490
   29.5879 3.016030   2  2  0    2   29.5850  3.016323   -0.0029 -0.000293
   29.7950 2.995540   0  2  1    2   29.7960  2.995443    0.0010  0.000097
   38.5552 2.332798   4  1  0    2   38.5517  2.333002   -0.0035 -0.000204
   39.9534 2.254337   0  3  1    2   39.9518  2.254422   -0.0016 -0.000086
   40.3310 2.234100  -1  1  2    2   40.3348  2.233900    0.0038  0.000201
   41.8123 2.158324  -2  0  2    2   41.8128  2.158301    0.0005  0.000022
   43.0668 2.098323  -4  1  1    2   43.0669  2.098320    0.0001  0.000004
   44.1875 2.047677  -2  3  1    2   44.1899  2.047572    0.0024  0.000106
   45.0391 2.010924   3  3  0    2   45.0401  2.010882    0.0010  0.000042
   47.4568 1.913975   0  4  0    2   47.4573  1.913957    0.0005  0.000018
   47.9437 1.895671  -4  2  1    2   47.9464  1.895568    0.0027  0.000102
   51.3298 1.778301   0  4  1    2   51.3269  1.778395   -0.0029 -0.000094
   54.7272 1.675677   4  1  2    2   54.7288  1.675632    0.0016  0.000045
   58.9533 1.565244  -4  2  2    2   58.9487  1.565355   -0.0046 -0.000111
   69.6997 1.347889   3  2  3    2   69.6983  1.347913   -0.0014 -0.000024
   76.6331 1.242293   6  4  0    2   76.6339  1.242282    0.0008  0.000011
   89.0652 1.098278  -4  4  3    2   89.0662  1.098268    0.0010  0.000010

 rmse = 0.00002611789
 
     A =9.7980(3)              B =7.6558(2)               C =4.8110(1)           
 Alpha =90                  Beta =89.935(2)           Gamma =90                  
 
 Volume = 360.89(1)