Institute of Experimental Mineralogy
                 Russian Academy of Sciences
     -------------------------------------------------
           142432, Chernogolovka, Moscow district
             A.V. Chichagov  +7(496)52-22320

                            ***

          ***      W W W - X R A Y P O L       ***
                  ***********************
CLINOFERROSILITE

8, t-pigeonite, at 600'C, f-pyroxenes, sf-Mg-Fe-pyroxenes, s-clinoenstatite

Mg(0.31)Fe(0.67)Ca(0.015)SiO(3)


Monoclinic  P 2(1)/c  Z = 8

R =0.034          NR =784

30 .5 .1990

Ref.Str.:

         J.R.Smyth (1974)

         * Amer. Mineral., 59, 1069-1082

Reserv:

         Clinohypersthene.

                   Initial data from BDM-file 

   Lattice parameters (cub. angs.,degr.):

             a =   9.762    alpha =   90.0 
             b =   9.046    beta  =  109.16
             c =   5.268    gamma =   90.0 

    Unit cell volume (cub. angs.) =   439.43

    Molar volume ( cub.cm/mol.) =    33.09

  Co-ordinates, thermal parameters, occupation for atomic positions:

NoP   x/a     y/b     z/c    B(j)   atom  / occupation

   1 0.2499  0.652   0.2333   1.83   Mg    = 0.51, Fe    = 0.49
   2 0.2534  0.0141  0.2296   2.16   Mg    = 0.13, Fe    = 0.84, Ca    = 0.03
   3 0.0435  0.3405  0.2833   1.05   Si    = 1.00
   4 0.5503  0.8359  0.2444   1.66   Si    = 1.00
   5 0.8681  0.3431  0.1656   1.3    O     = 1.00
   6 0.1271  0.4918  0.3394   1.9    O     = 1.00
   7 0.0997  0.2623  0.5801   2.0    O     = 1.00
   8 0.3783  0.8325  0.1361   1.9    O     = 1.00
   9 0.629   0.9825  0.3799   1.9    O     = 1.00
  10 0.602   0.7116  0.4937   2.3    O     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.2499     0.652      0.2333
     2       2     0.2534     0.0141     0.2296
     3       3     0.0435     0.3405     0.2833
     4       4     0.5503     0.8359     0.2444
     5       5     0.8681     0.3431     0.1656
     6       6     0.1271     0.4918     0.3394
     7       7     0.0997     0.2623     0.5801
     8       8     0.3783     0.8325     0.1361
     9       9     0.629      0.9825     0.3799
    10      10     0.602      0.7116     0.4937
    11       1     0.7501     0.152      0.2667
    12       2     0.7466     0.5141     0.2704
    13       3     0.9565     0.8405     0.2167
    14       4     0.4497     0.3359     0.2556
    15       5     0.1319     0.8431     0.3344
    16       6     0.8729     0.9918     0.1606
    17       7     0.9003     0.7623     0.9199
    18       8     0.6217     0.3325     0.3639
    19       9     0.371      0.4825     0.1201
    20      10     0.398      0.2116     0.0063
    21       1     0.2499     0.848      0.7333
    22       2     0.2534     0.4859     0.7296
    23       3     0.0435     0.1595     0.7833
    24       4     0.5503     0.6641     0.7444
    25       5     0.8681     0.1569     0.6656
    26       6     0.1271     0.0082     0.8394
    27       7     0.0997     0.2377     0.0801
    28       8     0.3783     0.6675     0.6361
    29       9     0.629      0.5175     0.8799
    30      10     0.602      0.7884     0.9937
    31       1     0.7501     0.348      0.7667
    32       2     0.7466     0.9859     0.7704
    33       3     0.9565     0.6595     0.7167
    34       4     0.4497     0.1641     0.7556
    35       5     0.1319     0.6569     0.8344
    36       6     0.8729     0.5082     0.6606
    37       7     0.9003     0.7377     0.4199
    38       8     0.6217     0.1675     0.8639
    39       9     0.371      0.0175     0.6201
    40      10     0.398      0.2884     0.5063


X-ray density (g/cm cub.)   =      3.68

MU (1/cm) =     182.967    Mass attenuation coefficient (cm**2/g) =     49.769

 Selected interatomic distances (cation-anion,anion-anion):

 NoP    Atom              Rad.sph.      C.N.    Distance     NoP N.
                           (angs.)               (angs.)

    1   Mg   ,Fe             2.592        6
                                                 2.0711       6
                                                 2.2183       8
                                                 2.2364       5
                                                 2.137        9
                                                 2.0851       8
                                                 2.0386       5
    2   Mg   ,Fe   ,Ca       2.88         6
                                                 2.1959       8
                                                 2.1294       5
                                                 2.7674      10
                                                 2.0211       6
                                                 2.4874       7
                                                 2.0001       9
    3    Si                  2.1          4
                                                 1.6186       5
                                                 1.5711       6
                                                 1.638        7
                                                 1.6423       7
    4    Si                  2.1          4
                                                 1.5865       8
                                                 1.5806       9
                                                 1.6759      10
                                                 1.619       10
    5    O                   3.264       11
                                                 2.7424       6
                                                 2.6783       7
                                                 3.1784       6
                                                 2.9216       8
                                                 3.1265       5
                                                 3.1265       5
                                                 2.6253       7
                                                 2.81         9
                                                 2.9921       6
                                                 3.0646       6
                                                 2.8854       8
    6    O                   3.264       10
                                                 2.7424       5
                                                 2.4924       7
                                                 3.1784       5
                                                 2.9692       9
                                                 2.6422       7
                                                 2.9097       8
                                                 2.9921       5
                                                 3.0646       5
                                                 3.2628       7
                                                 3.1025      10
    7    O                   3.264        9
                                                 2.6783       5
                                                 2.4924       6
                                                 3.0724      10
                                                 2.6253       5
                                                 2.6422       6
                                                 2.6434       7
                                                 2.6434       7
                                                 3.2628       6
                                                 3.0708      10
    8    O                   3.264       11
                                                 2.7234       9
                                                 2.6102      10
                                                 2.9216       5
                                                 3.1674       9
                                                 2.9097       6
                                                 3.0275       8
                                                 3.0275       8
                                                 2.5624      10
                                                 2.8854       5
                                                 3.0702       9
                                                 3.173        9
    9    O                   3.264       10
                                                 2.7234       8
                                                 2.5569      10
                                                 2.9692       6
                                                 3.1674       8
                                                 3.2156      10
                                                 2.81         5
                                                 2.6343      10
                                                 3.0702       8
                                                 3.173        8
                                                 3.1838       9
   10    O                   3.264       10
                                                 2.6102       8
                                                 2.5569       9
                                                 3.0724       7
                                                 3.2156       9
                                                 2.5624       8
                                                 2.6343       9
                                                 2.7241      10
                                                 2.7241      10
                                                 3.1025       6
                                                 3.0708       7

  X-ray diffraction powder data (II),  X-Ray W.L. =   1.78892(angs.):

  No   H   K   L   Theta 2*Theta    S       LPG   MF        F          I int.
                    ( degree )                                         *100

    1   1   0   0  5.566  11.133   0.054  209.59    2        2.0        0.9
    2   1   1   0  7.962  15.924   0.077  101.3     4       22.2      103.6
    3   2   0   0 11.186  22.373   0.108   50.25    2       58.3      176.6
    4   0   2   0 11.406  22.812   0.111   48.25    2        3.3        0.6
    5   1   1  -1 11.544  23.089   0.112   47.05    4       30.6       91.5
    6   0   1   1 11.838  23.677   0.115   44.64    4       16.9       26.4
    7   2   1   0 12.577  25.153   0.122   39.32    4        3.5        1.0
    8   1   2   0 12.725  25.449   0.123   38.36    4        0.9        0.1
    9   2   1  -1 13.792  27.584   0.133   32.35    4        0.7        0.0
   10   1   1   1 14.53   29.059   0.14    28.95    4        5.8        2.0
   11   1   2  -1 15.272  30.544   0.147   26.02    4       17.2       16.0
   12   0   2   1 15.5    31.0     0.149   25.21    4       44.3      102.3
   13   2   2   0 16.083  32.166   0.155   23.28    4      100.2      483.9
   14   3   0   0 16.918  33.836   0.163   20.86    2        7.1        1.1
   15   2   2  -1 17.07   34.14    0.164   20.46    4      149.7      950.0
   16   1   2   1 17.684  35.367   0.17    18.94    4       13.9        7.6
   17   3   1  -1 17.7    35.399   0.17    18.9     4       86.9      295.7
   18   3   1   0 17.899  35.798   0.172   18.44    4      109.9      461.0
   19   1   3   0 18.185  36.371   0.174   17.81    4       12.6        5.9
   20   2   1   1 18.683  37.366   0.179   16.79    4        4.7        0.8
   21   1   0  -2 19.891  39.782   0.19    14.61    2       20.8        6.6
   22   1   3  -1 20.115  40.229   0.192   14.25    4      126.4      471.8
   23   0   3   1 20.295  40.589   0.194   13.97    4       19.9       11.5
   24   2   0  -2 20.364  40.728   0.195   13.87    2        1.6        0.0
   25   3   2  -1 20.423  40.846   0.195   13.78    4        6.9        1.4
   26   3   2   0 20.6    41.199   0.197   13.52    4        3.4        0.3
   27   1   1  -2 20.751  41.502   0.198   13.3     4       21.8       13.1
   28   2   3   0 20.759  41.519   0.198   13.28    4       11.5        3.6
   29   0   0   2 21.069  42.139   0.201   12.85    2      176.5      414.5
   30   2   1  -2 21.208  42.417   0.202   12.66    4        2.1        0.1
   31   2   2   1 21.299  42.599   0.203   12.54    4       90.7      213.6
   32   2   3  -1 21.561  43.122   0.205   12.2     4       40.1       40.6
   33   0   1   2 21.891  43.783   0.208   11.79    4        4.5        0.5
   34   1   3   1 22.068  44.136   0.21    11.58    4       52.3       65.6
   35   3   0  -2 22.403  44.806   0.213   11.2     2        7.2        0.6
   36   4   1  -1 22.533  45.065   0.214   11.05    4        8.6        1.7
   37   4   0   0 22.83   45.66    0.217   10.73    2       32.4       11.7
   38   1   2  -2 23.174  46.349   0.22    10.37    4        2.9        0.2
   39   3   1  -2 23.187  46.374   0.22    10.36    4       13.9        4.1
   40   0   4   0 23.298  46.596   0.221   10.25    2       20.8        4.6
   41   2   2  -2 23.594  47.188   0.224    9.96    4       29.2       17.6
   42   4   1   0 23.603  47.206   0.224    9.95    4        4.7        0.4
   43   3   1   1 23.664  47.328   0.224    9.89    4       63.4       82.3
   44   1   0   2 23.698  47.396   0.225    9.86    2       49.0       24.6
   45   1   4   0 24.031  48.063   0.228    9.55    4        0.6        0.0
   46   0   2   2 24.224  48.447   0.229    9.38    4       42.0       34.2
   47   3   3  -1 24.4    48.799   0.231    9.23    4      134.9      347.7
   48   1   1   2 24.45   48.9     0.231    9.18    4       61.9       72.8
   49   3   3   0 24.553  49.107   0.232    9.1     4       23.8       10.7
   50   4   2  -1 24.818  49.636   0.235    8.88    4       62.3       71.4
   51   2   3   1 25.166  50.332   0.238    8.6     4       13.0        3.0
   52   3   2  -2 25.427  50.855   0.24     8.4     4       26.1       11.9
   53   1   4  -1 25.601  51.201   0.242    8.27    4       11.0        2.1
   54   4   0  -2 25.712  51.424   0.243    8.19    2      129.7      142.7
   55   0   4   1 25.75   51.5     0.243    8.16    4       54.7       50.5
   56   4   2   0 25.817  51.633   0.243    8.11    4       39.9       26.7
   57   3   2   1 25.874  51.747   0.244    8.07    4        5.3        0.5
   58   2   4   0 26.138  52.276   0.246    7.89    4       44.5       32.3
   59   4   1  -2 26.421  52.843   0.249    7.7     4       22.3        7.9
   60   1   2   2 26.611  53.222   0.25     7.57    4        4.6        0.3
   61   2   4  -1 26.814  53.628   0.252    7.44    4       52.8       43.0
   62   1   3  -2 26.833  53.665   0.252    7.43    4        0.1        0.0
   63   2   3  -2 27.21   54.421   0.256    7.2     4       10.9        1.8
   64   1   4   1 27.246  54.493   0.256    7.18    4       15.9        3.7
   65   2   0   2 27.461  54.922   0.258    7.05    2      114.9       96.5
   66   0   3   2 27.78   55.56    0.261    6.87    4        9.0        1.1
   67   5   1  -1 27.978  55.956   0.262    6.76    4        2.0        0.1
   68   2   1   2 28.14   56.28    0.264    6.67    4        0.7        0.0
   69   4   3  -1 28.321  56.642   0.265    6.57    4       29.3       11.7
   70   4   2  -2 28.476  56.952   0.267    6.49    4        9.0        1.1
   71   3   3  -2 28.878  57.757   0.27     6.29    4       26.1        8.9
   72   5   0   0 29.012  58.025   0.271    6.22    2        3.2        0.1
   73   4   1   1 29.227  58.454   0.273    6.12    4        1.8        0.0
   74   4   3   0 29.236  58.471   0.273    6.12    4        1.8        0.0
   75   3   4  -1 29.273  58.545   0.273    6.1     4       18.9        4.5
   76   3   3   1 29.288  58.576   0.273    6.09    4       49.2       30.5
   77   3   4   0 29.409  58.817   0.274    6.04    4        1.2        0.0
   78   5   1   0 29.668  59.336   0.277    5.92    4       37.7       17.4
   79   2   4   1 29.952  59.903   0.279    5.79    4       44.9       24.2
   80   5   2  -1 29.961  59.923   0.279    5.79    4       21.2        5.4
   81   1   3   2 29.969  59.938   0.279    5.79    4       28.4        9.7
   82   5   0  -2 30.001  60.002   0.28     5.77    2       22.0        2.9
   83   2   2   2 30.116  60.233   0.28     5.72    4       76.8       70.0
   84   1   5   0 30.253  60.506   0.282    5.67    4       89.2       93.4
   85   5   1  -2 30.644  61.287   0.285    5.51    4        2.0        0.0
   86   4   2   1 31.161  62.321   0.289    5.31    4       53.1       31.0
   87   2   1  -3 31.276  62.552   0.29     5.26    4        8.9        0.9
   88   1   4  -2 31.448  62.895   0.292    5.2     4       18.2        3.6
   89   5   2   0 31.585  63.171   0.293    5.15    4        9.7        1.0
   90   1   5  -1 31.609  63.218   0.293    5.14    4       32.3       11.1
   91   1   1  -3 31.669  63.338   0.293    5.12    4       38.2       15.5
   92   4   3  -2 31.706  63.412   0.294    5.11    4        7.1        0.5
   93   0   5   1 31.739  63.479   0.294    5.1     4       27.1        7.7
   94   2   4  -2 31.79   63.58    0.294    5.08    4       51.0       27.4
   95   2   5   0 32.08   64.159   0.297    4.98    4        5.7        0.3
   96   3   1  -3 32.091  64.181   0.297    4.98    4       43.1       19.1
   97   3   0   2 32.113  64.226   0.297    4.97    2       23.5        2.8
   98   0   4   2 32.309  64.618   0.299    4.9     4       33.9       11.7
   99   5   2  -2 32.527  65.054   0.301    4.83    4       21.3        4.6
  100   2   5  -1 32.676  65.352   0.302    4.78    4        1.5        0.0
  101   3   1   2 32.732  65.464   0.302    4.77    4       64.5       41.0
  102   4   4  -1 32.804  65.607   0.303    4.74    4        0.6        0.0
  103   1   5   1 33.06   66.12    0.305    4.67    4       28.6        7.9
  104   5   3  -1 33.105  66.209   0.305    4.65    4      145.1      202.9
  105   2   2  -3 33.14   66.279   0.306    4.64    4      121.4      141.7
  106   0   1   3 33.246  66.492   0.306    4.61    4       21.6        4.5
  107   2   3   2 33.251  66.503   0.307    4.61    4        4.2        0.2
  108   3   4  -2 33.316  66.632   0.307    4.59    4       14.3        1.9
  109   1   2  -3 33.521  67.041   0.309    4.53    4       23.5        5.2
  110   4   4   0 33.646  67.291   0.31     4.5     4       23.3        5.1
  111   3   4   1 33.694  67.388   0.31     4.48    4       15.1        2.1
  112   3   2  -3 33.93   67.861   0.312    4.42    4       12.0        1.3
  113   6   1  -1 33.966  67.931   0.312    4.41    4       17.3        2.7
  114   4   1  -3 34.066  68.132   0.313    4.38    4       22.6        4.6
  115   4   3   1 34.242  68.485   0.315    4.33    4       14.9        2.0
  116   1   4   2 34.325  68.65    0.315    4.31    4       15.1        2.0
  117   3   2   2 34.554  69.108   0.317    4.25    4       16.1        2.3
  118   5   3   0 34.647  69.295   0.318    4.23    4        4.7        0.2
  119   3   5  -1 34.884  69.767   0.32     4.17    4       62.3       33.6
  120   3   5   0 35.007  70.014   0.321    4.14    4       61.0       31.9
  121   0   2   3 35.055  70.11    0.321    4.13    4        3.2        0.1
  122   6   0  -2 35.099  70.199   0.321    4.12    2      107.4       49.2
  123   5   1   1 35.337  70.675   0.323    4.07    4        4.9        0.2
  124   2   5   1 35.503  71.006   0.325    4.03    4        4.5        0.2
  125   5   3  -2 35.548  71.096   0.325    4.02    4       17.8        2.6
  126   6   0   0 35.591  71.183   0.325    4.01    2      108.9       49.3
  127   6   1  -2 35.693  71.385   0.326    3.99    4        0.8        0.0
  128   6   2  -1 35.757  71.515   0.327    3.97    4       28.8        6.8
  129   4   2  -3 35.856  71.711   0.327    3.95    4        6.0        0.3
  130   1   1   3 35.929  71.857   0.328    3.93    4        4.9        0.2
  131   4   4  -2 35.95   71.899   0.328    3.93    4        0.6        0.0
  132   2   3  -3 36.136  72.271   0.33     3.89    4       60.8       29.8
  133   6   1   0 36.181  72.362   0.33     3.88    4        2.7        0.1
  134   0   6   0 36.39   72.779   0.332    3.84    2      157.1       98.1
  135   1   3  -3 36.502  73.005   0.333    3.82    4      112.4       99.9
  136   1   5  -2 36.881  73.762   0.335    3.74    4       36.3       10.2
  137   3   3  -3 36.897  73.794   0.336    3.74    4       57.8       25.9
  138   1   6   0 36.952  73.905   0.336    3.73    4        6.0        0.3
  139   5   2   1 37.1    74.201   0.337    3.7     4        2.9        0.1
  140   5   1  -3 37.115  74.23    0.337    3.7     4       17.2        2.3
  141   2   5  -2 37.199  74.398   0.338    3.68    4        7.1        0.4
  142   5   4  -1 37.272  74.543   0.339    3.67    4        8.5        0.5
  143   2   4   2 37.411  74.822   0.34     3.64    4       38.3       11.0
  144   6   2  -2 37.449  74.898   0.34     3.64    4       57.3       24.7
  145   3   3   2 37.499  74.999   0.34     3.63    4       10.6        0.8
  146   4   0   2 37.545  75.089   0.341    3.62    2      100.2       37.7
  147   1   2   3 37.681  75.361   0.342    3.6     4       13.2        1.3
  148   0   5   2 37.682  75.364   0.342    3.6     4       36.3        9.8
  149   6   2   0 37.929  75.857   0.344    3.56    4        7.9        0.5
  150   0   3   3 37.985  75.969   0.344    3.55    4       21.9        3.5
  151   4   1   2 38.123  76.245   0.345    3.52    4       19.3        2.7
  152   4   5  -1 38.145  76.29    0.345    3.52    4        0.3        0.0
  153   1   6  -1 38.189  76.379   0.346    3.51    4        4.4        0.1
  154   0   6   1 38.309  76.619   0.347    3.49    4       11.6        1.0
  155   4   4   1 38.355  76.711   0.347    3.49    4        0.4        0.0
  156   2   6   0 38.623  77.245   0.349    3.45    4       29.2        6.1
  157   3   5  -2 38.626  77.253   0.349    3.44    4       67.0       32.0
  158   6   3  -1 38.666  77.333   0.349    3.44    4        2.1        0.0
  159   5   4   0 38.743  77.486   0.35     3.43    4       13.2        1.2
  160   4   3  -3 38.762  77.524   0.35     3.42    4        5.4        0.2
  161   5   2  -3 38.848  77.695   0.351    3.41    4       24.8        4.3
  162   4   5   0 38.937  77.874   0.351    3.4     4        1.7        0.0
  163   3   5   1 38.983  77.966   0.352    3.39    4       51.5       18.7
  164   2   6  -1 39.175  78.35    0.353    3.36    4        7.5        0.4
  165   1   6   1 39.532  79.063   0.356    3.32    4       14.3        1.4
  166   1   5   2 39.58   79.16    0.356    3.31    4       42.0       12.1
  167   5   4  -2 39.608  79.216   0.356    3.31    4       18.7        2.4
  168   2   1   3 39.633  79.265   0.357    3.3     4        3.8        0.1
  169   4   2   2 39.841  79.683   0.358    3.27    4        8.0        0.4
  170   5   3   1 39.975  79.951   0.359    3.26    4      170.1      195.3
  171   2   4  -3 40.175  80.35    0.361    3.23    4       61.8       25.6
  172   6   3  -2 40.316  80.632   0.362    3.22    4       10.1        0.7
  173   1   4  -3 40.53   81.059   0.363    3.19    4        0.6        0.0
  174   1   3   3 40.543  81.086   0.363    3.19    4       85.3       48.1
  175   7   1  -1 40.571  81.143   0.364    3.19    4       34.2        7.7
  176   6   3   0 40.786  81.572   0.365    3.16    4        5.9        0.2
  177   3   4  -3 40.912  81.824   0.366    3.15    4        0.0        0.0
  178   7   0  -2 40.979  81.958   0.367    3.14    2       60.5       11.9
  179   4   5  -2 41.129  82.259   0.368    3.12    4        7.1        0.3
  180   6   1  -3 41.166  82.331   0.368    3.12    4       10.8        0.8
  181   3   6  -1 41.244  82.488   0.369    3.11    4        7.7        0.4
  182   2   2   3 41.334  82.669   0.369    3.1     4       40.1       10.3
  183   3   6   0 41.361  82.722   0.369    3.1     4        5.2        0.2
  184   3   4   2 41.497  82.995   0.37     3.09    4        8.2        0.4
  185   7   1  -2 41.544  83.088   0.371    3.08    4       85.6       46.8
  186   5   3  -3 41.688  83.377   0.372    3.07    4       77.9       38.6
  187   2   6   1 41.831  83.663   0.373    3.05    4        3.6        0.1
  188   0   4   3 41.97   83.94    0.374    3.04    4       31.3        6.2
  189   6   1   1 42.1    84.201   0.375    3.03    4        0.6        0.0
  190   7   2  -1 42.265  84.531   0.376    3.01    4        5.6        0.2
  191   5   5  -1 42.403  84.806   0.377    3.0     4       23.5        3.4
  192   2   5   2 42.538  85.076   0.378    2.99    4        2.0        0.0
  193   6   4  -1 42.637  85.273   0.379    2.98    4        2.6        0.0
  194   4   3   2 42.667  85.335   0.379    2.98    4        1.4        0.0
  195   4   4  -3 42.73   85.46    0.379    2.98    4       16.1        1.6
  196   7   0   0 42.766  85.531   0.38     2.97    2       13.1        0.5
  197   6   2  -3 42.856  85.711   0.38     2.97    4       15.5        1.5
  198   2   0  -4 42.88   85.759   0.38     2.96    2        5.9        0.1
  199   3   0  -4 42.952  85.905   0.381    2.96    2       67.1       13.8
  200   1   6  -2 43.15   86.3     0.382    2.94    4        0.6        0.0
  201   7   2  -2 43.232  86.463   0.383    2.94    4        3.2        0.1
  202   7   1   0 43.327  86.654   0.384    2.93    4       50.6       15.5
  203   2   1  -4 43.441  86.882   0.384    2.92    4       29.7        5.3
  204   4   5   1 43.456  86.911   0.384    2.92    4       11.6        0.8
  205   2   6  -2 43.456  86.912   0.384    2.92    4       25.5        3.9
  206   3   1  -4 43.514  87.027   0.385    2.92    4       44.6       12.0
  207   6   2   1 43.786  87.571   0.387    2.9     4       36.0        7.8
  208   5   0   2 43.791  87.583   0.387    2.9     2        2.4        0.0
  209   5   5   0 43.834  87.668   0.387    2.89    4       16.3        1.6
  210   1   0  -4 43.887  87.774   0.388    2.89    2       19.7        1.2
  211   5   4   1 43.922  87.844   0.388    2.89    4        1.2        0.0
  212   0   6   2 43.923  87.847   0.388    2.89    4      116.7       81.5
  213   4   0  -4 44.105  88.209   0.389    2.88    2      114.7       39.2
  214   2   3   3 44.145  88.291   0.389    2.88    4       22.9        3.1
  215   6   4  -2 44.258  88.516   0.39     2.87    4        4.8        0.1
  216   3   1   3 44.327  88.653   0.391    2.86    4       32.9        6.4
  217   1   7   0 44.34   88.68    0.391    2.86    4       12.8        1.0
  218   5   1   2 44.352  88.704   0.391    2.86    4       39.4        9.2
  219   4   6  -1 44.372  88.745   0.391    2.86    4       11.4        0.8
  220   1   1  -4 44.447  88.895   0.391    2.86    4       11.6        0.8
  221   1   4   3 44.482  88.964   0.392    2.86    4        2.1        0.0
  222   4   1  -4 44.665  89.33    0.393    2.85    4       27.0        4.3
  223   5   5  -2 44.681  89.363   0.393    2.84    4        8.1        0.4
  224   6   4   0 44.722  89.445   0.393    2.84    4       15.6        1.4
  225   3   6  -2 44.841  89.682   0.394    2.84    4       24.0        3.4


  X-ray diffraction powder data (I)...X-Ray wave length =  1.78892 (angs.):

  No   H   K   L   Theta 2*Theta    d           I int   I int.n.  I p.h.n.   H(Si)
                    ( degree )   (angstrem)     *100                         *100

    1   1   1   0   7.962  15.924  6.45755      103.6     10.9     11.1     5.6
    2   2   0   0  11.186  22.373  4.61062      176.6     18.6     18.8     5.6
    3   1   1  -1  11.544  23.089  4.46948       91.5      9.6      9.7     5.6
    4   0   1   1  11.838  23.677  4.36003       26.4      2.8      2.8     5.6
    5   1   2  -1  15.272  30.544  3.39577       16.0      1.7      1.7     5.6
    6   0   2   1  15.5    31.0    3.34702      102.3     10.8     10.8     5.6
    7   2   2   0  16.083  32.166  3.22878      483.9     50.9     51.0     5.6
    8   2   2  -1  17.07   34.14   3.04718      950.0    100.0    100.0     5.7
    9   3   1  -1  17.7    35.399  2.94204      303.3     31.9     31.9     5.7
   10   3   1   0  17.899  35.798  2.91033      461.0     48.5     48.5     5.7
   11   1   3  -1  20.115  40.229  2.60093      471.8     49.7     49.4     5.7
   12   0   3   1  20.295  40.589  2.57883       11.5      1.2      1.2     5.7
   13   1   1  -2  20.751  41.502  2.52453       16.7      1.8      1.8     5.7
   14   0   0   2  21.069  42.139  2.48809      414.5     43.6     43.3     5.7
   15   2   2   1  21.299  42.599  2.46245      213.6     22.5     22.3     5.7
   16   2   3  -1  21.561  43.122  2.43397       40.6      4.3      4.2     5.7
   17   1   3   1  22.068  44.136  2.38073       65.6      6.9      6.8     5.7
   18   4   0   0  22.83   45.66   2.30531       11.7      1.2      1.2     5.7
   19   2   2  -2  23.594  47.188  2.23474       18.1      1.9      1.9     5.7
   20   3   1   1  23.664  47.328  2.22849       82.3      8.7      8.5     5.7
   21   1   0   2  23.698  47.396  2.22549       24.6      2.6      2.6     5.7
   22   0   2   2  24.224  48.447  2.18002       34.2      3.6      3.5     5.7
   23   3   3  -1  24.4    48.799  2.16525      347.7     36.6     36.1     5.7
   24   1   1   2  24.45   48.9    2.16105       72.8      7.7      7.5     5.7
   25   3   3   0  24.553  49.107  2.15252       10.7      1.1      1.1     5.7
   26   4   2  -1  24.818  49.636  2.13099       71.4      7.5      7.4     5.7
   27   3   2  -2  25.427  50.855  2.0832        11.9      1.2      1.2     5.8
   28   4   0  -2  25.712  51.424  2.0617       142.7     15.0     14.7     5.8
   29   0   4   1  25.75   51.5    2.05886       50.5      5.3      5.2     5.8
   30   4   2   0  25.817  51.633  2.05391       26.7      2.8      2.8     5.8
   31   2   4   0  26.138  52.276  2.03041       32.3      3.4      3.3     5.8
   32   2   4  -1  26.814  53.628  1.98285       43.0      4.5      4.4     5.8
   33   2   0   2  27.461  54.922  1.93966       96.5     10.2      9.9     5.8
   34   4   3  -1  28.321  56.642  1.88541       11.7      1.2      1.2     5.8
   35   3   3   1  29.288  58.576  1.82841       35.0      3.7      3.6     5.8
   36   5   1   0  29.668  59.336  1.80708       17.4      1.8      1.8     5.8
   37   2   4   1  29.952  59.903  1.79154       39.2      4.1      4.0     5.8
   38   2   2   2  30.116  60.233  1.78265       70.0      7.4      7.1     5.8
   39   1   5   0  30.253  60.506  1.77535       93.4      9.8      9.5     5.8
   40   4   2   1  31.161  62.321  1.72863       31.0      3.3      3.2     5.8
   41   1   5  -1  31.609  63.218  1.7066        12.1      1.3      1.2     5.9
   42   1   1  -3  31.669  63.338  1.7037        15.5      1.6      1.6     5.9
   43   2   4  -2  31.79   63.58   1.69789       27.4      2.9      2.8     5.9
   44   3   1  -3  32.091  64.181  1.68366       22.0      2.3      2.2     5.9
   45   0   4   2  32.309  64.618  1.67351       11.7      1.2      1.2     5.9
   46   3   1   2  32.732  65.464  1.65424       41.0      4.3      4.2     5.9
   47   5   3  -1  33.105  66.209  1.63769      202.9     21.4     20.5     5.9
   48   2   2  -3  33.14   66.279  1.63617      141.7     14.9     14.3     5.9
   49   3   5  -1  34.884  69.767  1.56398       33.6      3.5      3.4     5.9
   50   3   5   0  35.007  70.014  1.55916       31.9      3.4      3.2     5.9
   51   6   0  -2  35.099  70.199  1.55559       49.2      5.2      4.9     5.9
   52   6   0   0  35.591  71.183  1.53687       49.3      5.2      4.9     5.9
   53   2   3  -3  36.136  72.271  1.51681       29.8      3.1      3.0     5.9
   54   0   6   0  36.39   72.779  1.50767       98.1     10.3      9.8     6.0
   55   1   3  -3  36.502  73.005  1.50366       99.9     10.5     10.0     6.0
   56   3   3  -3  36.897  73.794  1.48983       36.1      3.8      3.6     6.0
   57   2   4   2  37.411  74.822  1.4723        11.0      1.2      1.1     6.0
   58   6   2  -2  37.449  74.898  1.47102       24.7      2.6      2.5     6.0
   59   4   0   2  37.545  75.089  1.46783       37.7      4.0      3.7     6.0
   60   0   5   2  37.682  75.364  1.46326       11.1      1.2      1.1     6.0
   61   3   5  -2  38.626  77.253  1.43288       38.1      4.0      3.8     6.0
   62   3   5   1  38.983  77.966  1.42184       18.7      2.0      1.8     6.0
   63   1   5   2  39.58   79.16   1.40384       14.5      1.5      1.4     6.0
   64   5   3   1  39.975  79.951  1.39225      195.3     20.6     19.2     6.0
   65   2   4  -3  40.175  80.35   1.38649       25.6      2.7      2.5     6.0
   66   1   3   3  40.543  81.086  1.37606       55.8      5.9      5.5     6.1
   67   7   0  -2  40.979  81.958  1.36396       11.9      1.3      1.2     6.1
   68   2   2   3  41.334  82.669  1.35431       10.5      1.1      1.0     6.1
   69   7   1  -2  41.544  83.088  1.34872       46.8      4.9      4.6     6.1
   70   5   3  -3  41.688  83.377  1.34489       38.6      4.1      3.8     6.1
   71   3   0  -4  42.952  85.905  1.3127        13.8      1.5      1.3     6.1
   72   7   1   0  43.327  86.654  1.30357       15.5      1.6      1.5     6.1
   73   2   1  -4  43.441  86.882  1.30083       10.1      1.1      1.0     6.1
   74   3   1  -4  43.514  87.027  1.29909       12.0      1.3      1.2     6.1
   75   0   6   2  43.923  87.847  1.28941       81.5      8.6      7.9     6.2
   76   4   0  -4  44.105  88.209  1.2852        39.2      4.1      3.8     6.2
   77   5   1   2  44.352  88.704  1.27951       16.6      1.8      1.6     6.2

Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)