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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R050246
 
 Symmetry constraint is: MONOCLINIC2 
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.016
  
 Number of iterations =   0

         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   17.4855 5.072309  -1  1  1    2   17.4891  5.071285    0.0036  0.001024
   18.3833 4.826346   1  1  0    2   18.3860  4.825644    0.0027  0.000702
   19.8198 4.479381   0  2  0    2   19.8225  4.478776    0.0027  0.000605
   24.1446 3.685396   0  2  1    2   24.1443  3.685435   -0.0003 -0.000039
   25.5549 3.484989  -1  1  2    2   25.5599  3.484313    0.0050  0.000676
   29.0228 3.075745  -2  0  2    2   29.0194  3.076098   -0.0034 -0.000353
   31.2239 2.863648   2  0  0    2   31.2206  2.863943   -0.0033 -0.000295
   33.3467 2.685956  -1  3  1    2   33.3436  2.686202   -0.0031 -0.000246
   34.1229 2.626584   0  2  2    2   34.1220  2.626649   -0.0009 -0.000065
   35.3829 2.535841  -2  2  2    2   35.3858  2.535642    0.0029  0.000199
   38.3919 2.343646  -1  3  2    2   38.3933  2.343566    0.0014  0.000081
   39.7097 2.268823   1  3  1    2   39.7080  2.268915   -0.0017 -0.000092
   43.0881 2.098365  -3  1  1    2   43.0828  2.098612   -0.0053 -0.000247
   45.4333 1.995314   2  2  1    2   45.4363  1.995187    0.0030  0.000126
   46.6233 1.947102   0  2  3    2   46.6268  1.946963    0.0035  0.000139
   47.4887 1.913607  -1  3  3    2   47.4907  1.913532    0.0020  0.000075
   48.0839 1.891292  -2  0  4    2   48.0894  1.891087    0.0055  0.000205
   49.4421 1.842453   0  4  2    2   49.4345  1.842718   -0.0076 -0.000265
   51.8067 1.763752   2  4  0    2   51.7953  1.764115   -0.0114 -0.000362
   54.2319 1.690443  -3  3  3    2   54.2324  1.690428    0.0005  0.000015
   56.7371 1.621582   0  0  4    2   56.7425  1.621441    0.0054  0.000141
   57.8176 1.593813   1  5  1    2   57.8172  1.593823   -0.0004 -0.000010
   60.1253 1.538023  -4  0  4    2   60.1242  1.538049   -0.0011 -0.000027
   61.4742 1.507460   1  3  3    2   61.4773  1.507392    0.0031  0.000069
   63.9559 1.454804  -1  5  3    2   63.9577  1.454768    0.0018  0.000036
   67.9472 1.378715  -3  5  1    2   67.9538  1.378598    0.0066  0.000117
   70.0045 1.343137  -2  6  2    2   70.0067  1.343101    0.0022  0.000036
   73.1300 1.293238  -1  3  5    2   73.1217  1.293364   -0.0083 -0.000126

 rmse = 0.00005321337
 
     A =6.6915(4)              B =8.9576(3)               C =7.5768(3)           
 Alpha =90                  Beta =121.130(4)          Gamma =90                  
 
 Volume = 388.75(2)