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

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

4, syn, at 800'C, f-amphiboles, sf-glaucophane, s-richterite, DF

K(NaCa)Mg(5)Si(8)O(22)F(2)


Monoclinic  I 2/m  Z = 2

R =0.046          NR =1141

21 .9 .1990

Ref.Str.:

         Cameron M., Papike J.J. et al. (1983)

         * Amer. Mineral., 68, 924-943

                   Initial data from BDM-file 

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

             a =  10.104    alpha =   90.0 
             b =  18.159    beta  =  105.85
             c =   5.285    gamma =   90.0 

    Unit cell volume (cub. angs.) =   932.82

    Molar volume ( cub.cm/mol.) =   280.94

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

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

   1 0.1108  0.9146  0.8946   1.69   O     = 1.00
   2 0.1193  0.8306  0.3926   1.79   O     = 1.00
   3 0.1014  0.0     0.3884   2.52   O     = 1.00
   4 0.3613  0.7537  0.5591   2.47   O     = 1.00
   5 0.342   0.8722  0.2511   2.14   O     = 1.00
   6 0.3387  0.8814  0.7514   2.09   O     = 1.00
   7 0.3315  0.0     0.0264   2.25   O     = 1.00
   8 0.2749  0.9157  0.9768   1.25   Si    = 1.00
   9 0.2848  0.8293  0.4805   1.28   Si    = 1.00
  10 0.0     0.9098  0.5      1.66   Mg    = 1.00
  11 0.0     0.8191  0.0      1.89   Mg    = 1.00
  12 0.0     0.0     0.0      1.68   Mg    = 1.00
  13 0.0     0.7216  0.5      3.18   Ca    = 0.5 , Na    = 0.5 
  14 0.475   0.0     0.533    6.7    K     = 0.5 , K     = 0.0 


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.1108     0.9146     0.8946
     2       2     0.1193     0.8306     0.3926
     3       3     0.1014     0.0        0.3884
     4       4     0.3613     0.7537     0.5591
     5       5     0.342      0.8722     0.2511
     6       6     0.3387     0.8814     0.7514
     7       7     0.3315     0.0        0.0264
     8       8     0.2749     0.9157     0.9768
     9       9     0.2848     0.8293     0.4805
    10      10     0.0        0.9098     0.5   
    11      11     0.0        0.8191     0.0   
    12      12     0.0        0.0        0.0   
    13      13     0.0        0.7216     0.5   
    14      14     0.475      0.0        0.533 
    15       1     0.8892     0.0854     0.1054
    16       2     0.8807     0.1694     0.6074
    17       3     0.8986     0.0        0.6116
    18       4     0.6387     0.2463     0.4409
    19       5     0.658      0.1278     0.7489
    20       6     0.6613     0.1186     0.2486
    21       7     0.6685     0.0        0.9736
    22       8     0.7251     0.0843     0.0232
    23       9     0.7152     0.1707     0.5195
    24      10     0.0        0.0902     0.5   
    25      11     0.0        0.1809     0.0   
    26      13     0.0        0.2784     0.5   
    27      14     0.525      0.0        0.467 
    28       1     0.3892     0.5854     0.6054
    29       2     0.3807     0.6694     0.1074
    30       3     0.3986     0.5        0.1116
    31       4     0.1387     0.7463     0.9409
    32       5     0.158      0.6278     0.2489
    33       6     0.1613     0.6186     0.7486
    34       7     0.1685     0.5        0.4736
    35       8     0.2251     0.5843     0.5232
    36       9     0.2152     0.6707     0.0195
    37      10     0.5        0.5902     0.0   
    38      11     0.5        0.6809     0.5   
    39      12     0.5        0.5        0.5   
    40      13     0.5        0.7784     0.0   
    41      14     0.025      0.5        0.967 
    42       1     0.6108     0.4146     0.3946
    43       2     0.6193     0.3306     0.8926
    44       3     0.6014     0.5        0.8884
    45       4     0.8613     0.2537     0.0591
    46       5     0.842      0.3722     0.7511
    47       6     0.8387     0.3814     0.2514
    48       7     0.8315     0.5        0.5264
    49       8     0.7749     0.4157     0.4768
    50       9     0.7848     0.3293     0.9805
    51      10     0.5        0.4098     0.0   
    52      11     0.5        0.3191     0.5   
    53      13     0.5        0.2216     0.0   
    54      14     0.975      0.5        0.033 
    55       1     0.8892     0.9146     0.1054
    56       2     0.8807     0.8306     0.6074
    57       4     0.6387     0.7537     0.4409
    58       5     0.658      0.8722     0.7489
    59       6     0.6613     0.8814     0.2486
    60       8     0.7251     0.9157     0.0232
    61       9     0.7152     0.8293     0.5195
    62       1     0.1108     0.0854     0.8946
    63       2     0.1193     0.1694     0.3926
    64       4     0.3613     0.2463     0.5591
    65       5     0.342      0.1278     0.2511
    66       6     0.3387     0.1186     0.7514
    67       8     0.2749     0.0843     0.9768
    68       9     0.2848     0.1707     0.4805
    69       1     0.6108     0.5854     0.3946
    70       2     0.6193     0.6694     0.8926
    71       4     0.8613     0.7463     0.0591
    72       5     0.842      0.6278     0.7511
    73       6     0.8387     0.6186     0.2514
    74       8     0.7749     0.5843     0.4768
    75       9     0.7848     0.6707     0.9805
    76       1     0.3892     0.4146     0.6054
    77       2     0.3807     0.3306     0.1074
    78       4     0.1387     0.2537     0.9409
    79       5     0.158      0.3722     0.2489
    80       6     0.1613     0.3814     0.7486
    81       8     0.2251     0.4157     0.5232
    82       9     0.2152     0.3293     0.0195


X-ray density (g/cm cub.)   =      2.96

MU (1/cm) =     126.344    Mass attenuation coefficient (cm**2/g) =     42.648

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

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

    1    O                   3.264       12
                                                 3.0229       2
                                                 3.0818       2
                                                 3.0594       3
                                                 3.0712       3
                                                 2.6825       5
                                                 2.6815       6
                                                 2.6485       7
                                                 2.7363       3
                                                 3.0727       4
                                                 2.7599       1
                                                 2.8475       2
                                                 3.1016       1
    2    O                   3.264       11
                                                 3.0818       1
                                                 3.0229       1
                                                 3.0812       3
                                                 2.7437       4
                                                 2.6669       5
                                                 2.658        6
                                                 3.2355       4
                                                 2.8873       4
                                                 2.8475       1
                                                 2.9318       2
                                                 3.1202       4
    3    O                   3.264        9
                                                 3.0712       1
                                                 3.0594       1
                                                 3.0812       2
                                                 2.7363       1
                                                 2.6288       3
                                                 2.7363       1
                                                 3.0712       1
                                                 3.0594       1
                                                 3.0812       2
    4    O                   3.264        9
                                                 2.7437       2
                                                 2.673        5
                                                 2.5669       6
                                                 3.0727       1
                                                 3.2355       2
                                                 2.8873       2
                                                 3.2085       5
                                                 3.0336       4
                                                 3.1202       2
    5    O                   3.264        8
                                                 2.6825       1
                                                 2.6669       2
                                                 2.673        4
                                                 2.6586       6
                                                 2.6373       6
                                                 2.5958       7
                                                 3.2085       4
                                                 3.2342       6
    6    O                   3.264        7
                                                 2.6815       1
                                                 2.658        2
                                                 2.5669       4
                                                 2.6373       5
                                                 2.6586       5
                                                 2.6103       7
                                                 3.2342       5
    7    O                   3.264        6
                                                 2.6485       1
                                                 2.5958       5
                                                 2.6103       6
                                                 2.6485       1
                                                 2.5958       5
                                                 2.6103       6
    8    Si                  2.1          4
                                                 1.5953       1
                                                 1.6274       5
                                                 1.6254       6
                                                 1.6301       7
    9    Si                  2.1          4
                                                 1.6088       2
                                                 1.5746       4
                                                 1.6714       5
                                                 1.678        6
   10    Mg                  2.52         6
                                                 2.082        1
                                                 2.0536       2
                                                 2.1001       3
                                                 2.1001       3
                                                 2.082        1
                                                 2.0536       2
   11    Mg                  2.52         6
                                                 2.2162       1
                                                 2.1061       2
                                                 2.012        4
                                                 2.2162       1
                                                 2.1061       2
                                                 2.012        4
   12    Mg                  2.52         6
                                                 2.0759       1
                                                 2.0284       3
                                                 2.0759       1
                                                 2.0284       3
                                                 2.0759       1
                                                 2.0759       1
   13   Ca   ,Na             2.88         6
                                                 2.4631       2
                                                 2.4106       4
                                                 2.5906       6
                                                 2.4631       2
                                                 2.4106       4
                                                 2.5906       6
   14   K    ,K              3.228        8
                                                 2.884        5
                                                 2.9556       6
                                                 2.674        7
                                                 2.9923       5
                                                 2.5996       7
                                                 2.9923       5
                                                 2.884        5
                                                 2.9556       6

  X-ray diffraction powder data (II),  X-Ray W.L. =   1.54056(angs.):

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

    1   0   2   0  4.867   9.733   0.055  274.9     2       12.7       10.2
    2   1   1   0  5.157  10.314   0.058  244.56    4       33.4      125.7
    3   1   3   0  8.622  17.244   0.097   86.05    4        2.0        0.2
    4   1   0  -1  8.661  17.322   0.098   85.26    2        6.1        0.7
    5   0   1   1  9.052  18.104   0.102   77.86    4       40.8       59.5
    6   2   0   0  9.12   18.239   0.103   76.68    2       43.0       32.6
    7   0   4   0  9.769  19.538   0.11    66.55    2       85.7      112.4
    8   1   2  -1  9.953  19.906   0.112   64.03    4        5.8        1.0
    9   2   2   0 10.357  20.713   0.117   58.97    4        1.0        0.0
   10   1   0   1 10.906  21.811   0.123   52.98    2       11.0        1.5
   11   2   1  -1 11.053  22.107   0.124   51.51    4       59.5       83.8
   12   0   3   1 11.412  22.824   0.128   48.2     4       70.7      110.6
   13   1   2   1 11.967  23.933   0.135   43.64    4       17.6        6.2
   14   2   3  -1 13.072  26.143   0.147   36.24    4      161.6      435.1
   15   1   5   0 13.086  26.172   0.147   36.16    4       19.4        6.2
   16   1   4  -1 13.112  26.225   0.147   36.01    4       27.1       12.2
   17   2   4   0 13.426  26.852   0.151   34.25    4      144.9      330.4
   18   3   1   0 13.975  27.95    0.157   31.46    4      140.7      286.4
   19   3   0  -1 14.155  28.31    0.159   30.61    2       15.7        1.7
   20   2   1   1 14.536  29.071   0.163   28.93    4       62.6       52.1
   21   1   4   1 14.722  29.444   0.165   28.15    4       21.1        5.8
   22   0   6   0 14.745  29.489   0.165   28.06    2       10.6        0.7
   23   3   2  -1 15.001  30.003   0.168   27.04    4      138.2      237.3
   24   0   5   1 15.109  30.217   0.169   26.63    4       82.9       84.2
   25   3   3   0 15.644  31.288   0.175   24.71    4       88.7       89.3
   26   2   3   1 16.152  32.304   0.181   23.06    4      133.1      187.9
   27   2   5  -1 16.424  32.848   0.184   22.25    4      217.1      481.9
   28   1   1  -2 17.133  34.266   0.191   20.29    4       20.1        3.8
   29   1   6  -1 17.201  34.402   0.192   20.12    4      139.5      179.9
   30   3   4  -1 17.316  34.632   0.193   19.83    4       16.0        2.3
   31   2   6   0 17.447  34.895   0.195   19.5     4       18.8        3.2
   32   2   0  -2 17.528  35.056   0.195   19.31    2       92.0       37.5
   33   0   0   2 17.639  35.278   0.197   19.04    2      281.2      346.1
   34   1   7   0 17.898  35.796   0.199   18.45    4       20.1        3.4
   35   2   2  -2 18.234  36.468   0.203   17.71    4        9.1        0.7
   36   4   1  -1 18.34   36.679   0.204   17.49    4       17.0        2.3
   37   0   2   2 18.341  36.682   0.204   17.48    4       22.2        4.0
   38   3   0   1 18.354  36.708   0.204   17.46    2       26.2        2.8
   39   4   0   0 18.481  36.962   0.206   17.19    2       51.2       10.3
   40   1   6   1 18.489  36.979   0.206   17.18    4       37.5       11.1
   41   1   3  -2 18.547  37.094   0.206   17.06    4        3.0        0.1
   42   3   5   0 18.578  37.157   0.207   16.99    4       78.3       47.9
   43   2   5   1 19.017  38.034   0.212   16.14    4      129.2      123.9
   44   3   2   1 19.033  38.066   0.212   16.11    4      110.4       90.3
   45   4   2   0 19.156  38.313   0.213   15.88    4        5.9        0.3
   46   3   1  -2 19.442  38.884   0.216   15.37    4        1.8        0.0
   47   0   7   1 19.472  38.945   0.216   15.32    4      134.5      127.4
   48   1   1   2 19.644  39.288   0.218   15.02    4      112.1       86.7
   49   4   3  -1 19.679  39.358   0.219   14.96    4       28.8        5.7
   50   0   8   0 19.837  39.674   0.22    14.7     2       34.5        4.0
   51   2   4  -2 20.223  40.447   0.224   14.08    4       28.7        5.3
   52   0   4   2 20.322  40.643   0.225   13.93    4       86.4       47.8
   53   2   7  -1 20.542  41.084   0.228   13.6     4       60.3       22.7
   54   3   6  -1 20.668  41.336   0.229   13.42    4      157.6      153.1
   55   3   3  -2 20.721  41.442   0.23    13.34    4       15.1        1.4
   56   1   3   2 20.913  41.826   0.232   13.07    4       76.9       35.5
   57   3   4   1 20.958  41.917   0.232   13.0     4       11.9        0.8
   58   4   4   0 21.072  42.145   0.233   12.85    4       10.3        0.6
   59   1   5  -2 21.131  42.263   0.234   12.77    4       60.2       21.3
   60   1   8  -1 21.793  43.587   0.241   11.91    4        0.5        0.0
   61   4   0  -2 21.959  43.918   0.243   11.71    2      171.9       79.6
   62   2   8   0 21.996  43.992   0.243   11.67    4       31.4        5.3
   63   4   5  -1 22.153  44.306   0.245   11.48    4       88.0       40.9
   64   2   0   2 22.234  44.467   0.246   11.39    2      122.3       39.1
   65   3   7   0 22.357  44.715   0.247   11.25    4       53.6       14.9
   66   4   2  -2 22.547  45.095   0.249   11.03    4       11.9        0.7
   67   5   0  -1 22.558  45.117   0.249   11.02    2       10.6        0.3
   68   2   7   1 22.735  45.47    0.251   10.83    4       20.7        2.1
   69   2   2   2 22.816  45.633   0.252   10.74    4       10.3        0.5
   70   1   8   1 22.863  45.725   0.252   10.69    4        7.8        0.3
   71   4   1   1 22.904  45.809   0.253   10.65    4       14.6        1.0
   72   1   9   0 22.949  45.897   0.253   10.6     4       79.2       30.6
   73   3   5  -2 23.104  46.207   0.255   10.44    4       29.1        4.1
   74   5   2  -1 23.135  46.269   0.255   10.41    4       46.0       10.1
   75   2   6  -2 23.223  46.446   0.256   10.32    4        5.6        0.1
   76   1   5   2 23.28   46.56    0.257   10.26    4       78.1       28.8
   77   0   6   2 23.311  46.622   0.257   10.23    4        7.8        0.3
   78   5   1   0 23.485  46.969   0.259   10.06    4      113.7       59.8
   79   3   6   1 23.884  47.767   0.263    9.69    4       67.5       20.3
   80   4   6   0 23.987  47.973   0.264    9.59    4        5.9        0.2
   81   4   3   1 24.033  48.067   0.264    9.55    4       20.8        1.9
   82   4   4  -2 24.245  48.49    0.267    9.36    4       60.5       15.7
   83   0   9   1 24.251  48.502   0.267    9.36    4       93.9       37.9
   84   2   4   2 24.5    48.999   0.269    9.14    4       61.7       16.0
   85   1   7  -2 24.589  49.179   0.27     9.07    4       40.1        6.7
   86   5   3   0 24.593  49.187   0.27     9.06    4       63.0       16.5
   87   3   8  -1 24.726  49.452   0.272    8.95    4        6.5        0.2
   88   5   4  -1 24.801  49.603   0.272    8.89    4       21.4        1.9
   89   0  10   0 25.099  50.198   0.275    8.65    2      102.2       20.8
   90   2   9  -1 25.157  50.313   0.276    8.61    4       63.9       16.1
   91   5   1  -2 25.478  50.956   0.279    8.36    4       31.7        3.9
   92   4   7  -1 25.502  51.005   0.279    8.34    4       12.2        0.6
   93   3   1   2 25.805  51.61    0.283    8.12    4       63.7       15.1
   94   1   0  -3 26.075  52.15    0.285    7.93    2        5.3        0.1
   95   2   1  -3 26.145  52.289   0.286    7.88    4       30.2        3.3
   96   4   5   1 26.18   52.361   0.286    7.86    4       15.4        0.9
   97   3   7  -2 26.361  52.722   0.288    7.74    4       35.3        4.4
   98   1   7   2 26.521  53.042   0.29     7.63    4       15.4        0.8
   99   5   3  -2 26.525  53.049   0.29     7.63    4       20.6        1.5
  100   1   2  -3 26.593  53.187   0.291    7.58    4       13.9        0.7
  101   5   5   0 26.707  53.415   0.292    7.51    4       13.9        0.7
  102   3   9   0 26.727  53.454   0.292    7.5     4        1.9        0.0
  103   1  10  -1 26.752  53.503   0.292    7.48    4       33.6        3.9
  104   3   3   2 26.842  53.685   0.293    7.42    4        5.8        0.1
  105   3   0  -3 26.857  53.714   0.293    7.42    2       23.6        1.0
  106   4   6  -2 26.894  53.788   0.294    7.39    4        3.1        0.0
  107   2  10   0 26.925  53.851   0.294    7.37    4       46.6        7.4
  108   2   8  -2 26.983  53.966   0.295    7.34    4       59.8       12.1
  109   2   9   1 27.059  54.118   0.295    7.29    4       62.1       12.9
  110   0   8   2 27.062  54.123   0.295    7.29    4       92.5       28.6
  111   2   6   2 27.13   54.261   0.296    7.25    4        4.3        0.1
  112   0   1   3 27.162  54.323   0.296    7.23    4       31.8        3.4
  113   2   3  -3 27.173  54.346   0.296    7.22    4      101.7       34.3
  114   3   2  -3 27.365  54.73    0.298    7.11    4       98.1       31.4
  115   6   1  -1 27.38   54.759   0.299    7.1     4        4.5        0.1
  116   5   6  -1 27.411  54.823   0.299    7.08    4      201.1      131.5
  117   5   0   1 27.468  54.936   0.299    7.05    2        2.6        0.0
  118   3   8   1 27.577  55.154   0.3      6.98    4        2.1        0.0
  119   4   8   0 27.67   55.339   0.301    6.93    4       97.5       30.3
  120   1  10   1 27.676  55.351   0.301    6.93    4        1.1        0.0
  121   5   2   1 27.969  55.938   0.304    6.76    4       30.3        2.9
  122   1   4  -3 28.109  56.219   0.306    6.69    4       19.9        1.2
  123   0   3   3 28.164  56.329   0.306    6.66    4       29.7        2.7
  124   1  11   0 28.248  56.496   0.307    6.61    4      117.6       42.1
  125   6   3  -1 28.377  56.755   0.309    6.54    4        9.3        0.3
  126   6   0   0 28.391  56.782   0.309    6.54    2       94.6       13.4
  127   5   5  -2 28.537  57.074   0.31     6.46    4       27.3        2.2
  128   4   1  -3 28.67   57.34    0.311    6.39    4       19.1        1.1
  129   1   9  -2 28.708  57.416   0.312    6.37    4       16.9        0.8
  130   1   0   3 28.831  57.663   0.313    6.31    2       14.2        0.3
  131   3   5   2 28.84   57.68    0.313    6.31    4       35.0        3.5
  132   3   4  -3 28.854  57.707   0.313    6.3     4        9.6        0.3
  133   6   2   0 28.881  57.763   0.314    6.29    4       31.9        2.9
  134   2   5  -3 29.156  58.311   0.316    6.16    4      178.4       90.1
  135   4   7   1 29.189  58.378   0.317    6.14    4       61.8       10.8
  136   6   0  -2 29.281  58.561   0.317    6.1     2      105.1       15.5
  137   3  10  -1 29.316  58.632   0.318    6.08    4       54.4        8.3
  138   1   2   3 29.317  58.634   0.318    6.08    4        3.4        0.0
  139   0  11   1 29.379  58.758   0.318    6.05    4        1.4        0.0
  140   5   4   1 29.437  58.875   0.319    6.02    4        1.8        0.0
  141   4   9  -1 29.531  59.063   0.32     5.98    4       17.9        0.9
  142   4   3  -3 29.639  59.279   0.321    5.93    4        3.4        0.0
  143   4   0   2 29.653  59.306   0.321    5.93    2      207.6       58.7
  144   5   7   0 29.68   59.359   0.321    5.91    4       10.1        0.3
  145   6   2  -2 29.761  59.523   0.322    5.88    4       34.4        3.2
  146   0   5   3 30.104  60.209   0.326    5.73    4       19.7        1.0
  147   4   2   2 30.13   60.26    0.326    5.72    4       15.4        0.6
  148   2  11  -1 30.177  60.354   0.326    5.7     4       29.7        2.3
  149   6   5  -1 30.308  60.617   0.328    5.64    4      100.5       26.2
  150   3   9  -2 30.312  60.625   0.328    5.64    4       81.1       17.1
  151   6   4   0 30.322  60.644   0.328    5.64    4       19.3        1.0
  152   4   8  -2 30.329  60.659   0.328    5.63    4       17.6        0.8
  153   1   9   2 30.459  60.917   0.329    5.58    4       35.2        3.2
  154   1   6  -3 30.525  61.05    0.33     5.55    4      196.4       98.5
  155   2   8   2 30.548  61.097   0.33     5.54    4       77.2       15.2
  156   0  12   0 30.599  61.198   0.33     5.52    2      201.6       51.6
  157   1   4   3 30.745  61.489   0.332    5.47    4       19.3        0.9
  158   5   8  -1 30.809  61.618   0.332    5.44    4       18.0        0.8
  159   5   0  -3 30.997  61.995   0.334    5.37    2       13.6        0.2
  160   6   4  -2 31.177  62.354   0.336    5.3     4       86.6       18.3
  161   3   6  -3 31.233  62.466   0.337    5.28    4       38.9        3.7
  162   2  10  -2 31.348  62.696   0.338    5.24    4       33.6        2.7
  163   5   7  -2 31.397  62.794   0.338    5.22    4       37.8        3.4
  164   0  10   2 31.419  62.839   0.338    5.21    4       62.2        9.3
  165   5   2  -3 31.462  62.925   0.339    5.2     4       59.0        8.3
  166   2   1   3 31.491  62.982   0.339    5.18    4       25.2        1.5
  167   4   5  -3 31.523  63.046   0.339    5.17    4       25.6        1.6
  168   4   4   2 31.536  63.072   0.34     5.17    4       79.4       15.0
  169   3  11   0 31.58   63.159   0.34     5.15    4       74.8       13.2
  170   3   7   2 31.683  63.367   0.341    5.12    4       11.6        0.3
  171   5   6   1 31.79   63.581   0.342    5.08    4      223.4      116.5
  172   2  11   1 31.879  63.757   0.343    5.05    4       48.5        5.4
  173   3  10   1 31.89   63.78    0.343    5.04    4       46.2        4.9
  174   4  10   0 31.975  63.95    0.344    5.01    4       64.4        9.6
  175   2   7  -3 31.982  63.964   0.344    5.01    4       75.0       13.0
  176   1  12  -1 32.062  64.123   0.345    4.99    4       25.7        1.5
  177   2  12   0 32.217  64.434   0.346    4.93    4       44.3        4.5
  178   7   0  -1 32.252  64.504   0.346    4.92    2        6.7        0.1
  179   2   3   3 32.41   64.819   0.348    4.87    4       66.0        9.8
  180   6   1   1 32.595  65.19    0.35     4.81    4       14.9        0.5
  181   6   6   0 32.637  65.275   0.35     4.8     4       17.3        0.7
  182   7   2  -1 32.707  65.415   0.351    4.77    4       55.9        6.9
  183   5   4  -3 32.835  65.671   0.352    4.74    4        9.2        0.2
  184   0   7   3 32.883  65.765   0.352    4.72    4       36.0        2.8
  185   1  12   1 32.891  65.782   0.352    4.72    4       30.4        2.0
  186   4   9   1 32.924  65.848   0.353    4.71    4       34.0        2.5
  187   1   6   3 33.044  66.087   0.354    4.67    4       11.6        0.3
  188   6   7  -1 33.077  66.154   0.354    4.66    4       34.5        2.6
  189   1  11  -2 33.38   66.759   0.357    4.57    4        5.3        0.1
  190   5   9   0 33.383  66.766   0.357    4.57    4       11.4        0.3
  191   6   6  -2 33.459  66.919   0.358    4.55    4       18.7        0.7
  192   6   3   1 33.497  66.994   0.358    4.54    4       37.3        2.9
  193   1   8  -3 33.731  67.463   0.36     4.47    4       12.1        0.3
  194   7   1  -2 33.804  67.608   0.361    4.45    4      162.2       53.8
  195   7   1   0 33.804  67.608   0.361    4.45    4       76.4       11.9
  196   4   6   2 33.805  67.61    0.361    4.45    4        6.8        0.1
  197   1  13   0 33.856  67.712   0.362    4.44    4        8.2        0.1
  198   7   4  -1 34.054  68.108   0.363    4.38    4       16.9        0.6
  199   4  11  -1 34.138  68.275   0.364    4.36    4       13.6        0.4
  200   2   5   3 34.207  68.414   0.365    4.34    4       97.5       19.0
  201   5   1   2 34.217  68.434   0.365    4.34    4       27.5        1.5
  202   6   1  -3 34.23   68.46    0.365    4.34    4        0.6        0.0
  203   4   7  -3 34.237  68.475   0.365    4.34    4       34.6        2.4
  204   3  12  -1 34.383  68.765   0.367    4.3     4       14.2        0.4
  205   3   8  -3 34.404  68.807   0.367    4.29    4        3.4        0.0
  206   4  10  -2 34.436  68.871   0.367    4.28    4       54.7        5.9
  207   3   0   3 34.581  69.163   0.368    4.25    2       14.1        0.2
  208   2  10   2 34.641  69.281   0.369    4.23    4       38.2        2.8
  209   7   3  -2 34.691  69.381   0.369    4.22    4       85.4       14.2
  210   7   3   0 34.691  69.381   0.369    4.22    4       53.5        5.5
  211   3  11  -2 34.861  69.722   0.371    4.18    4      116.2       26.0
  212   0  13   1 34.881  69.762   0.371    4.17    4       33.9        2.2
  213   5  10  -1 34.885  69.77    0.371    4.17    4       33.9        2.2
  214   5   8   1 34.934  69.869   0.372    4.16    4       28.0        1.5
  215   1  11   2 34.997  69.994   0.372    4.15    4       90.3       15.5
  216   5   9  -2 35.0    70.0     0.372    4.14    4       18.8        0.7
  217   3   2   3 35.021  70.043   0.373    4.14    4       43.2        3.6
  218   5   6  -3 35.061  70.123   0.373    4.13    4      107.8       22.1
  219   5   3   2 35.098  70.197   0.373    4.12    4       33.3        2.1
  220   6   3  -3 35.112  70.223   0.373    4.12    4       10.6        0.2
  221   6   5   1 35.267  70.534   0.375    4.08    4      147.5       40.8
  222   3   9   2 35.271  70.542   0.375    4.08    4       65.4        8.0
  223   2   9  -3 35.554  71.108   0.377    4.02    4       53.9        5.4
  224   2  13  -1 35.611  71.222   0.378    4.0     4       43.5        3.5
  225   2   0  -4 35.664  71.329   0.378    3.99    2       59.6        3.3
  226   6   8   0 35.744  71.488   0.379    3.97    4       71.3        9.3
  227   3   1  -4 36.085  72.169   0.382    3.9     4      127.7       29.3
  228   2   2  -4 36.099  72.197   0.382    3.9     4        6.3        0.1
  229   1   8   3 36.133  72.267   0.383    3.89    4        7.2        0.1
  230   1   1  -4 36.219  72.437   0.384    3.87    4       63.3        7.1
  231   7   6  -1 36.244  72.489   0.384    3.87    4       91.0       14.7
  232   2  12  -2 36.26   72.52    0.384    3.87    4      127.0       28.7
  233   0  12   2 36.327  72.653   0.385    3.85    4      194.9       67.3
  234   3   4   3 36.327  72.654   0.385    3.85    4       14.4        0.4
  235   0   9   3 36.412  72.823   0.385    3.83    4       52.5        4.9
  236   0  14   0 36.431  72.863   0.385    3.83    2       16.0        0.2
  237   7   5  -2 36.434  72.868   0.386    3.83    4       44.6        3.5
  238   7   5   0 36.434  72.868   0.386    3.83    4        6.2        0.1
  239   6   8  -2 36.533  73.066   0.386    3.81    4       21.8        0.8
  240   6   9  -1 36.597  73.195   0.387    3.8     4       14.5        0.4
  241   3  12   1 36.766  73.532   0.389    3.76    4       10.5        0.2
  242   2   7   3 36.824  73.648   0.389    3.75    4       26.3        1.2
  243   5   5   2 36.834  73.668   0.389    3.75    4       25.3        1.1
  244   4  12   0 36.845  73.691   0.389    3.75    4       61.4        6.5
  245   6   5  -3 36.847  73.694   0.389    3.75    4       36.3        2.3
  246   4   8   2 36.866  73.731   0.389    3.75    4       46.1        3.7
  247   3  13   0 36.906  73.813   0.39     3.74    4       15.8        0.4
  248   3   3  -4 36.947  73.894   0.39     3.73    4       72.1        8.9
  249   4   0  -4 37.038  74.077   0.391    3.71    2      115.2       11.3
  250   1   3  -4 37.08   74.159   0.391    3.71    4       51.6        4.5
  251   2  13   1 37.185  74.369   0.392    3.69    4       31.9        1.7
  252   0   0   4 37.303  74.607   0.393    3.66    2      160.6       21.7
  253   4  11   1 37.31   74.62    0.393    3.66    4        3.4        0.0
  254   2   4  -4 37.389  74.778   0.394    3.65    4       36.2        2.2
  255   4   2  -4 37.466  74.933   0.395    3.64    4        8.7        0.1
  256   1  10  -3 37.651  75.301   0.397    3.6     4       14.8        0.4
  257   4   9  -3 37.709  75.419   0.397    3.59    4       35.0        2.0
  258   8   1  -1 37.715  75.431   0.397    3.59    4       12.8        0.3
  259   0   2   4 37.73   75.46    0.397    3.59    4       11.5        0.2
  260   5  11   0 37.745  75.49    0.397    3.59    4       36.3        2.2
  261   1  14  -1 37.782  75.564   0.398    3.58    4       30.1        1.5
  262   6   7   1 37.854  75.707   0.398    3.57    4       68.0        7.6
  263   7   0  -3 37.856  75.711   0.398    3.57    2        2.0        0.0
  264   7   0   1 37.856  75.712   0.398    3.57    2        2.6        0.0
  265   2  14   0 37.926  75.853   0.399    3.56    4       28.5        1.3
  266   5   8  -3 38.079  76.158   0.4      3.53    4       12.4        0.3
  267   7   2  -3 38.28   76.561   0.402    3.5     4       51.7        4.3
  268   7   2   1 38.281  76.561   0.402    3.5     4       39.9        2.6
  269   3  10  -3 38.294  76.588   0.402    3.5     4       49.0        3.9
  270   3   6   3 38.464  76.929   0.404    3.47    4        7.8        0.1
  271   4   1   3 38.503  77.007   0.404    3.46    4       10.0        0.2
  272   1  14   1 38.555  77.111   0.405    3.46    4       38.5        2.4
  273   8   3  -1 38.564  77.129   0.405    3.45    4       24.3        0.9
  274   8   0  -2 38.576  77.152   0.405    3.45    2       80.0        5.1
  275   1  13  -2 38.591  77.182   0.405    3.45    4       59.7        5.6
  276   3   5  -4 38.65   77.3     0.405    3.44    4       35.4        2.0
  277   4   4  -4 38.74   77.481   0.406    3.43    4       14.0        0.3
  278   1   5  -4 38.781  77.562   0.407    3.42    4       12.5        0.2
  279   5  10   1 38.803  77.607   0.407    3.42    4       36.9        2.1
  280   5   1  -4 38.934  77.867   0.408    3.4     4       17.8        0.5
  281   7   7  -2 38.992  77.983   0.408    3.39    4        3.8        0.0
  282   7   7   0 38.992  77.983   0.408    3.39    4       28.4        1.3
  283   8   2  -2 38.998  77.997   0.408    3.39    4        1.0        0.0
  284   0   4   4 39.001  78.003   0.409    3.39    4       43.2        2.9
  285   6   0   2 39.033  78.067   0.409    3.38    2       59.8        2.8
  286   4  12  -2 39.17   78.339   0.41     3.37    4       27.2        1.1
  287   7   8  -1 39.228  78.456   0.411    3.36    4       18.3        0.5
  288   5  11  -2 39.288  78.575   0.411    3.35    4       15.8        0.4
  289   4  13  -1 39.307  78.614   0.411    3.35    4       28.5        1.2
  290   1   1   4 39.325  78.649   0.411    3.34    4       13.7        0.3
  291   8   0   0 39.345  78.69    0.412    3.34    2      107.4        8.9
  292   4   3   3 39.347  78.694   0.412    3.34    4       13.7        0.3
  293   2  12   2 39.365  78.73    0.412    3.34    4       25.2        1.0
  294   5   7   2 39.382  78.765   0.412    3.34    4       15.8        0.4
  295   6   7  -3 39.395  78.79    0.412    3.33    4       12.2        0.2
  296   6   2   2 39.454  78.908   0.412    3.33    4        6.2        0.1
  297   2   6  -4 39.507  79.013   0.413    3.32    4        9.1        0.1
  298   7   4  -3 39.546  79.092   0.413    3.31    4        5.7        0.0
  299   7   4   1 39.546  79.092   0.413    3.31    4       24.2        0.9
  300   3  11   2 39.548  79.096   0.413    3.31    4      128.5       25.2
  301   6  10   0 39.583  79.167   0.414    3.31    4       20.1        0.6
  302   5  12  -1 39.598  79.196   0.414    3.31    4       16.5        0.4
  303   8   2   0 39.765  79.529   0.415    3.28    4       13.6        0.3
  304   5   3  -4 39.775  79.55    0.415    3.28    4       36.7        2.0
  305   2  11  -3 39.82   79.64    0.416    3.28    4       34.6        1.8
  306   1  15   0 39.881  79.762   0.416    3.27    4       12.2        0.2
  307   3  14  -1 39.959  79.918   0.417    3.26    4       33.6        1.7
  308   1  10   3 39.96   79.919   0.417    3.26    4       13.8        0.3
  309   3  13  -2 39.994  79.989   0.417    3.26    4       35.6        1.9
  310   1  13   2 40.124  80.248   0.418    3.24    4        8.7        0.1
  311   1   3   4 40.163  80.327   0.419    3.23    4       10.4        0.2
  312   2   9   3 40.211  80.423   0.419    3.23    4       33.0        1.6
  313   8   5  -1 40.246  80.492   0.419    3.22    4       15.1        0.3
  314   8   4  -2 40.258  80.515   0.419    3.22    4        0.1        0.0
  315   6  10  -2 40.347  80.693   0.42     3.21    4       22.3        0.7
  316   0  11   3 40.647  81.294   0.423    3.18    4        5.2        0.0
  317   4  10   2 40.67   81.339   0.423    3.17    4       67.6        6.7
  318   6   4   2 40.71   81.42    0.423    3.17    4       85.2       10.6
  319   6  11  -1 40.826  81.653   0.424    3.16    4       18.7        0.5
  320   4   6  -4 40.837  81.674   0.424    3.16    4        2.3        0.0
  321   0  15   1 40.849  81.698   0.425    3.15    4       57.7        4.8
  322   8   4   0 41.018  82.036   0.426    3.14    4        5.6        0.0
  323   4   5   3 41.02   82.041   0.426    3.14    4       40.7        2.4
  324   0   6   4 41.095  82.19    0.427    3.13    4        0.7        0.0
  325   3   7  -4 41.165  82.33    0.427    3.12    4       15.0        0.3
  326   6   9   1 41.216  82.431   0.428    3.12    4       15.5        0.3
  327   1   7  -4 41.294  82.587   0.428    3.11    4       13.6        0.3
  328   6   0  -4 41.321  82.642   0.429    3.1     2      146.6       15.3
  329   3   8   3 41.398  82.796   0.429    3.1     4       11.3        0.2
  330   5   5  -4 41.444  82.888   0.43     3.09    4        5.5        0.0
  331   2  15  -1 41.543  83.086   0.43     3.08    4       49.7        3.5
  332   7   6  -3 41.633  83.266   0.431    3.07    4       81.4        9.4
  333   7   6   1 41.633  83.267   0.431    3.07    4       33.6        1.6
  334   6   2  -4 41.736  83.472   0.432    3.06    4       16.3        0.4
  335   2  14  -2 41.749  83.498   0.432    3.06    4       21.0        0.6
  336   0  14   2 41.813  83.626   0.433    3.06    4        5.0        0.0
  337   1   5   4 41.829  83.659   0.433    3.05    4       17.4        0.4
  338   2   0   4 41.835  83.669   0.433    3.05    2       11.1        0.1
  339   5  10  -3 41.851  83.703   0.433    3.05    4       53.6        4.0
  340   4  11  -3 41.905  83.811   0.434    3.05    4        3.8        0.0
  341   3  14   1 42.235  84.471   0.436    3.02    4       21.6        0.6
  342   2   2   4 42.249  84.499   0.436    3.02    4       15.5        0.3
  343   1  12  -3 42.263  84.526   0.437    3.01    4       14.1        0.3
  344   8   1  -3 42.299  84.598   0.437    3.01    4        6.3        0.1
  345   4  14   0 42.312  84.624   0.437    3.01    4       12.8        0.2
  346   7   9  -2 42.331  84.661   0.437    3.01    4       46.6        3.0
  347   7   9   0 42.331  84.661   0.437    3.01    4       87.0       10.5
  348   8   6  -2 42.337  84.675   0.437    3.01    4       28.7        1.1
  349   4  13   1 42.347  84.694   0.437    3.01    4       17.0        0.4
  350   2   8  -4 42.423  84.847   0.438    3.0     4        3.5        0.0
  351   5   9   2 42.715  85.43    0.44     2.98    4       30.6        1.3
  352   6   9  -3 42.727  85.455   0.44     2.98    4       23.9        0.8
  353   8   7  -1 42.74   85.479   0.441    2.97    4       32.0        1.4
  354   0  16   0 42.742  85.484   0.441    2.97    2        1.9        0.0
  355   5  13   0 42.769  85.537   0.441    2.97    4       59.1        4.8
  356   3  15   0 42.785  85.569   0.441    2.97    4        2.9        0.0
  357   6   6   2 42.786  85.571   0.441    2.97    4       23.5        0.8
  358   5   0   3 42.819  85.639   0.441    2.97    2        2.8        0.0
  359   3  12  -3 42.889  85.779   0.442    2.96    4        8.8        0.1
  360   7  10  -1 42.976  85.953   0.443    2.96    4       21.7        0.6
  361   6   4  -4 42.979  85.957   0.443    2.96    4       12.9        0.2
  362   2  15   1 43.053  86.106   0.443    2.95    4       22.0        0.7
  363   8   6   0 43.091  86.183   0.443    2.95    4       29.7        1.2
  364   8   3  -3 43.126  86.252   0.444    2.94    4       49.2        3.3
  365   5   2   3 43.233  86.466   0.445    2.94    4        2.6        0.0
  366   5  12   1 43.387  86.774   0.446    2.93    4       14.7        0.3
  367   9   0  -1 43.431  86.862   0.446    2.92    2       10.0        0.1
  368   2   4   4 43.49   86.98    0.447    2.92    4       70.1        6.6
  369   4   7   3 43.507  87.013   0.447    2.92    4       72.8        7.1
  370   4   8  -4 43.738  87.476   0.449    2.9     4       40.1        2.1
  371   8   1   1 43.806  87.611   0.449    2.9     4       16.0        0.3
  372   9   2  -1 43.844  87.688   0.45     2.89    4       23.3        0.7
  373   5   7  -4 43.927  87.854   0.45     2.89    4       20.6        0.6
  374   0   8   4 43.993  87.987   0.451    2.88    4        5.1        0.0
  375   1  16  -1 44.043  88.087   0.451    2.88    4       60.3        4.8
  376   9   1  -2 44.098  88.197   0.452    2.88    4       32.5        1.4
  377   6  12   0 44.152  88.303   0.452    2.88    4       39.1        2.0
  378   2  16   0 44.184  88.367   0.452    2.87    4        7.6        0.1
  379   5  13  -2 44.274  88.548   0.453    2.87    4       56.8        4.2
  380   1   7   4 44.31   88.62    0.453    2.87    4       20.6        0.6
  381   2  11   3 44.357  88.715   0.454    2.86    4       10.6        0.1
  382   1  15  -2 44.418  88.835   0.454    2.86    4       28.9        1.1
  383   5   4   3 44.471  88.942   0.455    2.86    4       12.2        0.2
  384   3   9  -4 44.475  88.951   0.455    2.86    4       24.4        0.8
  385   1  12   3 44.522  89.044   0.455    2.85    4       23.6        0.7
  386   7   8  -3 44.528  89.055   0.455    2.85    4        3.5        0.0
  387   7   8   1 44.528  89.055   0.455    2.85    4       23.7        0.7
  388   3  13   2 44.529  89.058   0.455    2.85    4       45.0        2.7
  389   4  14  -2 44.571  89.141   0.456    2.85    4        1.2        0.0
  390   1   9  -4 44.603  89.206   0.456    2.85    4       10.4        0.1
  391   7   1  -4 44.609  89.217   0.456    2.85    4       76.5        7.7
  392   7   1   2 44.609  89.218   0.456    2.85    4       54.8        3.9
  393   8   3   1 44.631  89.261   0.456    2.85    4       10.8        0.2
  394   2  14   2 44.762  89.524   0.457    2.84    4       13.1        0.2
  395   8   5  -3 44.777  89.554   0.457    2.84    4       56.7        4.2
  396   1  16   1 44.795  89.59    0.457    2.84    4       45.1        2.7
  397   2  13  -3 44.797  89.593   0.457    2.84    4       18.5        0.4
  398   6  12  -2 44.903  89.806   0.458    2.83    4       75.5        7.4
  399   9   3  -2 44.923  89.847   0.458    2.83    4       63.7        5.3
  400   5  14  -1 44.991  89.982   0.459    2.83    4       75.2        7.4


  X-ray diffraction powder data (I)...X-Ray wave length =  1.54056 (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   0   2   0   4.867   9.733  9.0795        10.2      2.1      2.2     5.6
    2   1   1   0   5.157  10.314  8.56946      125.7     26.1     26.5     5.6
    3   0   1   1   9.052  18.104  4.8958        59.5     12.3     12.5     5.6
    4   2   0   0   9.12   18.239  4.85992       32.6      6.8      6.8     5.6
    5   0   4   0   9.769  19.538  4.53975      112.4     23.3     23.6     5.6
    6   2   1  -1  11.053  22.107  4.01765       83.8     17.4     17.5     5.6
    7   0   3   1  11.412  22.824  3.89304      110.6     23.0     23.1     5.6
    8   1   2   1  11.967  23.933  3.715          6.2      1.3      1.3     5.6
    9   2   3  -1  13.072  26.143  3.40576      441.3     91.6     92.1     5.6
   10   1   4  -1  13.112  26.225  3.39538       12.2      2.5      2.5     5.6
   11   2   4   0  13.426  26.852  3.31751      330.4     68.6     68.9     5.6
   12   3   1   0  13.975  27.95   3.18958      286.4     59.4     59.7     5.6
   13   2   1   1  14.536  29.071  3.06905       52.1     10.8     10.9     5.6
   14   1   4   1  14.722  29.444  3.03102        6.5      1.3      1.3     5.6
   15   3   2  -1  15.001  30.003  2.97587      237.3     49.2     49.4     5.6
   16   0   5   1  15.109  30.217  2.95523       84.2     17.5     17.5     5.6
   17   3   3   0  15.644  31.288  2.85649       89.3     18.5     18.6     5.6
   18   2   3   1  16.152  32.304  2.76894      187.9     39.0     39.0     5.6
   19   2   5  -1  16.424  32.848  2.72433      481.9    100.0    100.0     5.6
   20   1   6  -1  17.201  34.402  2.60472      179.9     37.3     37.3     5.7
   21   2   0  -2  17.528  35.056  2.55758       37.5      7.8      7.8     5.7
   22   0   0   2  17.639  35.278  2.54203      346.1     71.8     71.7     5.7
   23   3   0   1  18.354  36.708  2.44622        9.0      1.9      1.9     5.7
   24   1   6   1  18.489  36.979  2.42893       21.4      4.4      4.4     5.7
   25   3   5   0  18.578  37.157  2.4177        47.9     10.0      9.9     5.7
   26   2   5   1  19.017  38.034  2.36393      214.3     44.5     44.3     5.7
   27   0   7   1  19.472  38.945  2.31072      127.4     26.4     26.3     5.7
   28   1   1   2  19.644  39.288  2.29128       86.7     18.0     17.9     5.7
   29   4   3  -1  19.679  39.358  2.28741        5.7      1.2      1.2     5.7
   30   2   4  -2  20.223  40.447  2.22829        5.3      1.1      1.1     5.7
   31   0   4   2  20.322  40.643  2.21799       47.8      9.9      9.8     5.7
   32   2   7  -1  20.542  41.084  2.19519       22.7      4.7      4.7     5.7
   33   3   6  -1  20.668  41.336  2.18237      153.1     31.8     31.5     5.7
   34   1   3   2  20.913  41.826  2.15797       35.5      7.4      7.3     5.7
   35   1   5  -2  21.131  42.263  2.13665       21.3      4.4      4.4     5.7
   36   4   0  -2  21.959  43.918  2.05987       79.6     16.5     16.3     5.7
   37   2   8   0  21.996  43.992  2.05661        5.3      1.1      1.1     5.7
   38   4   5  -1  22.153  44.306  2.04276       40.9      8.5      8.4     5.7
   39   2   0   2  22.234  44.467  2.03571       39.1      8.1      8.0     5.7
   40   3   7   0  22.357  44.715  2.02502       14.9      3.1      3.0     5.7
   41   1   9   0  22.949  45.897  1.97555       30.6      6.3      6.3     5.7
   42   5   2  -1  23.135  46.269  1.96053       10.1      2.1      2.1     5.7
   43   1   5   2  23.28   46.56   1.94898       28.8      6.0      5.9     5.7
   44   5   1   0  23.485  46.969  1.93292       59.8     12.4     12.2     5.7
   45   3   6   1  23.884  47.767  1.90248       20.3      4.2      4.1     5.7
   46   0   9   1  24.251  48.502  1.87538       53.7     11.1     11.0     5.7
   47   2   4   2  24.5    48.999  1.8575        16.0      3.3      3.3     5.7
   48   5   3   0  24.593  49.187  1.85086       23.2      4.8      4.7     5.7
   49   0  10   0  25.099  50.198  1.8159        20.8      4.3      4.2     5.7
   50   2   9  -1  25.157  50.313  1.81202       16.1      3.3      3.3     5.8
   51   3   1   2  25.805  51.61   1.76951       15.1      3.1      3.1     5.8
   52   2  10   0  26.925  53.851  1.70104        7.4      1.5      1.5     5.8
   53   2   8  -2  26.983  53.966  1.69769       12.1      2.5      2.5     5.8
   54   0   8   2  27.062  54.123  1.69312       41.6      8.6      8.4     5.8
   55   2   3  -3  27.173  54.346  1.68669       37.7      7.8      7.6     5.8
   56   3   2  -3  27.365  54.73   1.67576       31.5      6.5      6.4     5.8
   57   5   6  -1  27.411  54.823  1.67316      131.5     27.3     26.7     5.8
   58   4   8   0  27.67   55.339  1.65875       30.3      6.3      6.1     5.8
   59   1  11   0  28.248  56.496  1.62751       42.1      8.7      8.5     5.8
   60   6   0   0  28.391  56.782  1.61997       13.4      2.8      2.7     5.8
   61   2   5  -3  29.156  58.311  1.58109       90.1     18.7     18.2     5.8
   62   4   7   1  29.189  58.378  1.57945       10.8      2.2      2.2     5.8
   63   6   0  -2  29.281  58.561  1.57493       15.5      3.2      3.1     5.8
   64   3  10  -1  29.316  58.632  1.57319        8.3      1.7      1.7     5.8
   65   4   0   2  29.653  59.306  1.55692       59.0     12.2     11.9     5.8
   66   6   5  -1  30.308  60.617  1.52635       45.0      9.3      9.0     5.8
   67   1   6  -3  30.525  61.05   1.51656      113.7     23.6     22.8     5.8
   68   0  12   0  30.599  61.198  1.51325       51.6     10.7     10.4     5.8
   69   6   4  -2  31.177  62.354  1.48794       18.3      3.8      3.7     5.8
   70   0  10   2  31.419  62.839  1.47761       12.7      2.6      2.5     5.9
   71   5   2  -3  31.462  62.925  1.47581        9.8      2.0      2.0     5.9
   72   4   4   2  31.536  63.072  1.47272       16.5      3.4      3.3     5.9
   73   3  11   0  31.58   63.159  1.47089       13.2      2.7      2.6     5.9
   74   5   6   1  31.79   63.581  1.46215      116.5     24.2     23.3     5.9
   75   2  11   1  31.879  63.757  1.45853       10.4      2.2      2.1     5.9
   76   2   7  -3  31.982  63.964  1.45431       22.5      4.7      4.5     5.9
   77   2   3   3  32.41   64.819  1.43718        9.8      2.0      1.9     5.9
   78   7   2  -1  32.707  65.415  1.42553        6.9      1.4      1.4     5.9
   79   7   1  -2  33.804  67.608  1.38451       65.9     13.7     13.1     5.9
   80   2   5   3  34.207  68.414  1.37016       20.5      4.3      4.1     5.9
   81   4  10  -2  34.436  68.871  1.36217        5.9      1.2      1.2     5.9
   82   7   3  -2  34.691  69.381  1.3534        19.7      4.1      3.9     5.9
   83   3  11  -2  34.861  69.722  1.34762       30.4      6.3      6.0     5.9
   84   1  11   2  34.997  69.994  1.34305       19.8      4.1      3.9     5.9
   85   5   6  -3  35.061  70.123  1.34089       22.1      4.6      4.4     5.9
   86   6   5   1  35.267  70.534  1.33407       48.8     10.1      9.7     5.9
   87   2   9  -3  35.554  71.108  1.32471        5.4      1.1      1.1     5.9
   88   6   8   0  35.744  71.488  1.3186         9.3      1.9      1.8     5.9
   89   3   1  -4  36.085  72.169  1.30782       29.3      6.1      5.8     5.9
   90   2  12  -2  36.26   72.52   1.30236       50.5     10.5     10.0     5.9
   91   0  12   2  36.327  72.653  1.30029       67.6     14.0     13.3     6.0
   92   0   9   3  36.412  72.823  1.29768        8.6      1.8      1.7     6.0
   93   6   5  -3  36.847  73.694  1.28449       14.7      3.1      2.9     6.0
   94   3   3  -4  36.947  73.894  1.2815         8.9      1.9      1.8     6.0
   95   4   0  -4  37.038  74.077  1.27879       11.3      2.3      2.2     6.0
   96   0   0   4  37.303  74.607  1.27102       21.7      4.5      4.3     6.0
   97   6   7   1  37.854  75.707  1.25525        7.6      1.6      1.5     6.0
   98   7   2  -3  38.28   76.561  1.24337       10.7      2.2      2.1     6.0
   99   8   0  -2  38.576  77.152  1.23531       14.0      2.9      2.7     6.0
  100   8   0   0  39.345  78.69   1.21498       10.1      2.1      2.0     6.0
  101   3  11   2  39.548  79.096  1.20976       25.2      5.2      4.9     6.0
  102   4  10   2  40.67   81.339  1.18196        6.7      1.4      1.3     6.1
  103   6   4   2  40.71   81.42   1.181         10.6      2.2      2.0     6.1
  104   0  15   1  40.849  81.698  1.17767        4.8      1.0      0.9     6.1
  105   6   0  -4  41.321  82.642  1.16661       15.3      3.2      3.0     6.1
  106   7   6  -3  41.633  83.266  1.15943       10.9      2.3      2.1     6.1
  107   7   9   0  42.331  84.661  1.14385       15.0      3.1      2.9     6.1
  108   5  13   0  42.769  85.537  1.13437        9.0      1.9      1.7     6.1
  109   4   7   3  43.507  87.013  1.11888       13.7      2.8      2.6     6.1
  110   1  16  -1  44.043  88.087  1.10799        4.8      1.0      0.9     6.2
  111   7   1  -4  44.609  89.217  1.09686       11.8      2.4      2.2     6.2
  112   8   5  -3  44.777  89.554  1.0936         7.3      1.5      1.4     6.2
  113   6  12  -2  44.903  89.806  1.09118       12.7      2.6      2.4     6.2
  114   5  14  -1  44.991  89.982  1.08952        7.4      1.5      1.4     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)