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

2, syn, at 400'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 =0.045          NR =1156

20 .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 =  10.041    alpha =   90.0 
             b =  18.056    beta  =  105.83
             c =   5.27     gamma =   90.0 

    Unit cell volume (cub. angs.) =   919.22

    Molar volume ( cub.cm/mol.) =   276.84

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

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

   1 0.1112  0.9147  0.8918   1.06   O     = 1.00
   2 0.118   0.831   0.3924   1.18   O     = 1.00
   3 0.1018  0.0     0.3877   1.58   O     = 1.00
   4 0.3608  0.7522  0.5605   1.6    O     = 1.00
   5 0.3437  0.8708  0.2506   1.32   O     = 1.00
   6 0.3404  0.882   0.7503   1.41   O     = 1.00
   7 0.3343  0.0     0.0297   1.55   O     = 1.00
   8 0.2762  0.9155  0.977    0.78   Si    = 1.00
   9 0.2854  0.8289  0.4807   0.8    Si    = 1.00
  10 0.0     0.9102  0.5      1.01   Mg    = 1.00
  11 0.0     0.8202  0.0      1.14   Mg    = 1.00
  12 0.0     0.0     0.0      0.99   Mg    = 1.00
  13 0.0     0.7222  0.5      1.94   Ca    = 0.5 , Na    = 0.5 
  14 0.482   0.0     0.525    5.9    K     = 0.5 , K     = 0.0 


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.1112     0.9147     0.8918
     2       2     0.118      0.831      0.3924
     3       3     0.1018     0.0        0.3877
     4       4     0.3608     0.7522     0.5605
     5       5     0.3437     0.8708     0.2506
     6       6     0.3404     0.882      0.7503
     7       7     0.3343     0.0        0.0297
     8       8     0.2762     0.9155     0.977 
     9       9     0.2854     0.8289     0.4807
    10      10     0.0        0.9102     0.5   
    11      11     0.0        0.8202     0.0   
    12      12     0.0        0.0        0.0   
    13      13     0.0        0.7222     0.5   
    14      14     0.482      0.0        0.525 
    15       1     0.8888     0.0853     0.1082
    16       2     0.882      0.169      0.6076
    17       3     0.8982     0.0        0.6123
    18       4     0.6392     0.2478     0.4395
    19       5     0.6563     0.1292     0.7494
    20       6     0.6596     0.118      0.2497
    21       7     0.6657     0.0        0.9703
    22       8     0.7238     0.0845     0.023 
    23       9     0.7146     0.1711     0.5193
    24      10     0.0        0.0898     0.5   
    25      11     0.0        0.1798     0.0   
    26      13     0.0        0.2778     0.5   
    27      14     0.518      0.0        0.475 
    28       1     0.3888     0.5853     0.6082
    29       2     0.382      0.669      0.1076
    30       3     0.3982     0.5        0.1123
    31       4     0.1392     0.7478     0.9395
    32       5     0.1563     0.6292     0.2494
    33       6     0.1596     0.618      0.7497
    34       7     0.1657     0.5        0.4703
    35       8     0.2238     0.5845     0.523 
    36       9     0.2146     0.6711     0.0193
    37      10     0.5        0.5898     0.0   
    38      11     0.5        0.6798     0.5   
    39      12     0.5        0.5        0.5   
    40      13     0.5        0.7778     0.0   
    41      14     0.018      0.5        0.975 
    42       1     0.6112     0.4147     0.3918
    43       2     0.618      0.331      0.8924
    44       3     0.6018     0.5        0.8877
    45       4     0.8608     0.2522     0.0605
    46       5     0.8437     0.3708     0.7506
    47       6     0.8404     0.382      0.2503
    48       7     0.8343     0.5        0.5297
    49       8     0.7762     0.4155     0.477 
    50       9     0.7854     0.3289     0.9807
    51      10     0.5        0.4102     0.0   
    52      11     0.5        0.3202     0.5   
    53      13     0.5        0.2222     0.0   
    54      14     0.982      0.5        0.025 
    55       1     0.8888     0.9147     0.1082
    56       2     0.882      0.831      0.6076
    57       4     0.6392     0.7522     0.4395
    58       5     0.6563     0.8708     0.7494
    59       6     0.6596     0.882      0.2497
    60       8     0.7238     0.9155     0.023 
    61       9     0.7146     0.8289     0.5193
    62       1     0.1112     0.0853     0.8918
    63       2     0.118      0.169      0.3924
    64       4     0.3608     0.2478     0.5605
    65       5     0.3437     0.1292     0.2506
    66       6     0.3404     0.118      0.7503
    67       8     0.2762     0.0845     0.977 
    68       9     0.2854     0.1711     0.4807
    69       1     0.6112     0.5853     0.3918
    70       2     0.618      0.669      0.8924
    71       4     0.8608     0.7478     0.0605
    72       5     0.8437     0.6292     0.7506
    73       6     0.8404     0.618      0.2503
    74       8     0.7762     0.5845     0.477 
    75       9     0.7854     0.6711     0.9807
    76       1     0.3888     0.4147     0.6082
    77       2     0.382      0.331      0.1076
    78       4     0.1392     0.2522     0.9395
    79       5     0.1563     0.3708     0.2494
    80       6     0.1596     0.382      0.7497
    81       8     0.2238     0.4155     0.523 
    82       9     0.2146     0.3289     0.0193


X-ray density (g/cm cub.)   =      3.01

MU (1/cm) =     128.213    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
                                                 3.0249       2
                                                 3.0518       2
                                                 3.057        3
                                                 3.0499       3
                                                 2.6917       5
                                                 2.6716       6
                                                 2.6515       7
                                                 2.7198       3
                                                 3.0307       4
                                                 2.7707       1
                                                 2.8184       2
                                                 3.0804       1
    2    O                   3.264       11
                                                 3.0518       1
                                                 3.0249       1
                                                 3.0555       3
                                                 2.7522       4
                                                 2.6711       5
                                                 2.6635       6
                                                 3.2063       4
                                                 2.8768       4
                                                 2.8184       1
                                                 2.8927       2
                                                 3.0857       4
    3    O                   3.264        9
                                                 3.0499       1
                                                 3.057        1
                                                 3.0555       2
                                                 2.7198       1
                                                 2.6269       3
                                                 2.7198       1
                                                 3.0499       1
                                                 3.057        1
                                                 3.0555       2
    4    O                   3.264        9
                                                 2.7522       2
                                                 2.6701       5
                                                 2.5782       6
                                                 3.0307       1
                                                 3.2063       2
                                                 2.8768       2
                                                 3.1623       5
                                                 3.0321       4
                                                 3.0857       2
    5    O                   3.264        8
                                                 2.6917       1
                                                 2.6711       2
                                                 2.6701       4
                                                 2.6504       6
                                                 2.6355       6
                                                 2.5974       7
                                                 3.1623       4
                                                 3.1797       6
    6    O                   3.264        7
                                                 2.6716       1
                                                 2.6635       2
                                                 2.5782       4
                                                 2.6355       5
                                                 2.6504       5
                                                 2.6001       7
                                                 3.1797       5
    7    O                   3.264        6
                                                 2.6515       1
                                                 2.5974       5
                                                 2.6001       6
                                                 2.6515       1
                                                 2.5974       5
                                                 2.6001       6
    8    Si                  2.1          4
                                                 1.594        1
                                                 1.6299       5
                                                 1.6214       6
                                                 1.63         7
    9    Si                  2.1          4
                                                 1.6176       2
                                                 1.5793       4
                                                 1.6652       5
                                                 1.6777       6
   10    Mg                  2.52         6
                                                 2.0637       1
                                                 2.0339       2
                                                 2.0867       3
                                                 2.0867       3
                                                 2.0637       1
                                                 2.0339       2
   11    Mg                  2.52         6
                                                 2.1979       1
                                                 2.0932       2
                                                 2.0018       4
                                                 2.1979       1
                                                 2.0932       2
                                                 2.0018       4
   12    Mg                  2.52         6
                                                 2.0716       1
                                                 2.0199       3
                                                 2.0716       1
                                                 2.0199       3
                                                 2.0716       1
                                                 2.0716       1
   13   Ca   ,Na             2.88         8
                                                 2.4395       2
                                                 2.4012       4
                                                 2.8562       5
                                                 2.5863       6
                                                 2.4395       2
                                                 2.4012       4
                                                 2.8562       5
                                                 2.5863       6
   14   K    ,K              3.228        8
                                                 2.8924       5
                                                 2.9819       6
                                                 2.6269       7
                                                 2.9622       5
                                                 2.5589       7
                                                 2.9622       5
                                                 2.8924       5
                                                 2.9819       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  4.894   9.789   0.055  271.76    2       13.3       11.4
    2   1   1   0  5.188  10.377   0.059  241.58    4       32.4      119.8
    3   1   3   0  8.673  17.345   0.098   85.02    4        1.1        0.1
    4   1   0  -1  8.69   17.381   0.098   84.67    2        4.7        0.5
    5   0   1   1  9.079  18.159   0.102   77.39    4       40.5       60.1
    6   2   0   0  9.176  18.353   0.104   75.71    2       37.7       25.5
    7   0   4   0  9.825  19.65    0.111   65.77    2       85.3      113.3
    8   1   2  -1  9.993  19.985   0.113   63.51    4        5.3        0.8
    9   2   2   0 10.42   20.84    0.117   58.23    4        1.3        0.0
   10   1   0   1 10.945  21.89    0.123   52.58    2        9.8        1.2
   11   2   1  -1 11.108  22.215   0.125   50.99    4       61.7       92.0
   12   0   3   1 11.458  22.916   0.129   47.79    4       68.7      106.8
   13   1   2   1 12.014  24.028   0.135   43.28    4       17.7        6.4
   14   2   3  -1 13.139  26.279   0.148   35.85    4      161.6      443.1
   15   1   5   0 13.163  26.326   0.148   35.71    4       18.8        6.0
   16   1   4  -1 13.175  26.35    0.148   35.65    4       27.0       12.3
   17   2   4   0 13.507  27.014   0.152   33.82    4      144.7      335.1
   18   3   1   0 14.063  28.126   0.158   31.04    4      142.4      297.9
   19   3   0  -1 14.236  28.472   0.16    30.24    2       13.6        1.3
   20   2   1   1 14.601  29.203   0.164   28.65    4       62.5       52.9
   21   1   4   1 14.79   29.58    0.166   27.87    4       19.7        5.1
   22   0   6   0 14.831  29.661   0.166   27.71    2       11.3        0.8
   23   3   2  -1 15.088  30.176   0.169   26.71    4      145.6      267.9
   24   0   5   1 15.181  30.363   0.17    26.36    4       82.7       85.3
   25   3   3   0 15.741  31.483   0.176   24.38    4       92.5       98.8
   26   2   3   1 16.229  32.459   0.181   22.83    4      135.4      198.1
   27   2   5  -1 16.514  33.027   0.185   21.98    4      216.7      488.5
   28   1   1  -2 17.184  34.368   0.192   20.16    4       21.7        4.5
   29   1   6  -1 17.291  34.583   0.193   19.89    4      149.6      210.7
   30   3   4  -1 17.417  34.834   0.194   19.58    4       15.1        2.1
   31   2   6   0 17.552  35.105   0.196   19.25    4       20.5        3.8
   32   2   0  -2 17.589  35.179   0.196   19.16    2       92.7       39.0
   33   0   0   2 17.689  35.378   0.197   18.93    2      286.5      367.7
   34   1   7   0 18.004  36.008   0.201   18.21    4       20.7        3.7
   35   2   2  -2 18.301  36.602   0.204   17.57    4        7.3        0.4
   36   0   2   2 18.397  36.794   0.205   17.37    4       23.3        4.5
   37   3   0   1 18.447  36.895   0.205   17.26    2       27.5        3.1
   38   4   1  -1 18.453  36.907   0.205   17.25    4       12.7        1.3
   39   1   6   1 18.584  37.168   0.207   16.98    4       38.9       12.2
   40   4   0   0 18.599  37.199   0.207   16.95    2       48.3        9.4
   41   1   3  -2 18.61   37.221   0.207   16.93    4        6.0        0.3
   42   3   5   0 18.693  37.386   0.208   16.77    4       82.6       54.1
   43   2   5   1 19.115  38.229   0.213   15.96    4      134.7      137.1
   44   3   2   1 19.131  38.263   0.213   15.93    4      117.4      103.9
   45   4   2   0 19.279  38.558   0.214   15.66    4        5.2        0.2
   46   3   1  -2 19.526  39.052   0.217   15.23    4        0.6        0.0
   47   0   7   1 19.576  39.151   0.217   15.14    4      137.7      135.9
   48   1   1   2 19.708  39.416   0.219   14.92    4      113.3       90.6
   49   4   3  -1 19.801  39.602   0.22    14.76    4       36.0        9.1
   50   0   8   0 19.955  39.91    0.222   14.51    2       38.0        5.0
   51   2   4  -2 20.307  40.613   0.225   13.95    4       32.6        7.0
   52   0   4   2 20.395  40.79    0.226   13.82    4       91.8       55.2
   53   2   7  -1 20.659  41.318   0.229   13.43    4       59.7       22.7
   54   3   6  -1 20.791  41.582   0.23    13.24    4      168.1      177.1
   55   3   3  -2 20.815  41.63    0.231   13.21    4       13.8        1.2
   56   1   3   2 20.987  41.975   0.232   12.96    4       80.8       40.0
   57   3   4   1 21.07   42.141   0.233   12.85    4        9.1        0.5
   58   4   4   0 21.206  42.413   0.235   12.67    4       15.6        1.5
   59   1   5  -2 21.216  42.432   0.235   12.65    4       63.6       24.2
   60   1   8  -1 21.915  43.831   0.242   11.76    4        0.0        0.0
   61   4   0  -2 22.07   44.14    0.244   11.58    2      184.3       93.1
   62   2   8   0 22.13   44.26    0.245   11.51    4       35.0        6.7
   63   4   5  -1 22.291  44.581   0.246   11.32    4       88.9       42.4
   64   2   0   2 22.317  44.634   0.246   11.29    2      131.7       46.4
   65   3   7   0 22.496  44.992   0.248   11.09    4       57.4       17.3
   66   4   2  -2 22.663  45.326   0.25    10.91    4       10.4        0.6
   67   5   0  -1 22.705  45.41    0.251   10.86    2        5.7        0.1
   68   2   7   1 22.859  45.719   0.252   10.7     4       21.6        2.4
   69   2   2   2 22.904  45.809   0.253   10.65    4       10.1        0.5
   70   1   8   1 22.988  45.977   0.254   10.56    4        7.1        0.3
   71   4   1   1 23.031  46.063   0.254   10.52    4       12.4        0.8
   72   1   9   0 23.088  46.175   0.255   10.46    4       84.1       35.1
   73   3   5  -2 23.216  46.432   0.256   10.33    4       23.4        2.7
   74   5   2  -1 23.285  46.57    0.257   10.26    4       42.6        8.8
   75   2   6  -2 23.33   46.66    0.257   10.21    4        8.6        0.4
   76   1   5   2 23.374  46.749   0.258   10.17    4       80.6       31.3
   77   0   6   2 23.409  46.818   0.258   10.14    4        7.7        0.3
   78   5   1   0 23.638  47.277   0.26     9.92    4      118.1       65.5
   79   3   6   1 24.016  48.033   0.264    9.56    4       69.6       22.0
   80   4   6   0 24.139  48.279   0.265    9.45    4        6.4        0.2
   81   4   3   1 24.168  48.337   0.266    9.43    4       23.5        2.5
   82   4   4  -2 24.373  48.746   0.268    9.25    4       59.9       15.7
   83   0   9   1 24.388  48.776   0.268    9.24    4       99.9       43.7
   84   2   4   2 24.602  49.203   0.27     9.06    4       67.0       19.2
   85   1   7  -2 24.702  49.404   0.271    8.97    4       45.3        8.7
   86   5   3   0 24.754  49.508   0.272    8.93    4       63.5       17.0
   87   3   8  -1 24.876  49.752   0.273    8.83    4        9.4        0.4
   88   5   4  -1 24.963  49.925   0.274    8.76    4       25.1        2.6
   89   0  10   0 25.252  50.505   0.277    8.53    2      102.7       21.3
   90   2   9  -1 25.306  50.611   0.277    8.49    4       64.6       16.8
   91   5   1  -2 25.623  51.245   0.281    8.25    4       38.1        5.7
   92   4   7  -1 25.663  51.325   0.281    8.23    4        8.8        0.3
   93   3   1   2 25.916  51.833   0.284    8.04    4       69.0       18.1
   94   1   0  -3 26.152  52.304   0.286    7.88    2        6.4        0.1
   95   2   1  -3 26.229  52.458   0.287    7.83    4       33.1        4.1
   96   4   5   1 26.331  52.662   0.288    7.76    4       13.6        0.7
   97   3   7  -2 26.498  52.997   0.29     7.65    4       38.0        5.2
   98   1   7   2 26.642  53.284   0.291    7.55    4       17.7        1.1
   99   1   2  -3 26.675  53.351   0.291    7.53    4        8.3        0.2
  100   5   3  -2 26.677  53.354   0.291    7.53    4       21.6        1.7
  101   5   5   0 26.882  53.765   0.294    7.4     4       19.3        1.3
  102   3   9   0 26.896  53.791   0.294    7.39    4        6.1        0.1
  103   1  10  -1 26.909  53.818   0.294    7.38    4       38.1        5.1
  104   3   0  -3 26.955  53.91    0.294    7.35    2       19.9        0.7
  105   3   3   2 26.963  53.925   0.294    7.35    4        5.8        0.1
  106   4   6  -2 27.042  54.084   0.295    7.3     4        2.4        0.0
  107   2  10   0 27.093  54.186   0.296    7.27    4       46.0        7.3
  108   2   8  -2 27.119  54.239   0.296    7.25    4       61.2       12.9
  109   0   8   2 27.19   54.38    0.297    7.21    4       94.5       30.5
  110   2   9   1 27.215  54.429   0.297    7.2     4       65.0       14.4
  111   0   1   3 27.243  54.486   0.297    7.18    4       31.8        3.4
  112   2   6   2 27.254  54.509   0.297    7.17    4        5.2        0.1
  113   2   3  -3 27.267  54.534   0.297    7.16    4      110.2       41.2
  114   3   2  -3 27.468  54.936   0.299    7.05    4      109.0       39.6
  115   6   1  -1 27.565  55.129   0.3      6.99    4        4.3        0.1
  116   5   6  -1 27.59   55.181   0.301    6.98    4      215.3      153.1
  117   5   0   1 27.63   55.261   0.301    6.95    2        2.8        0.0
  118   3   8   1 27.737  55.474   0.302    6.89    4        1.9        0.0
  119   1  10   1 27.836  55.673   0.303    6.84    4        2.3        0.0
  120   4   8   0 27.848  55.695   0.303    6.83    4      103.1       34.3
  121   5   2   1 28.135  56.27    0.306    6.67    4       28.6        2.6
  122   1   4  -3 28.205  56.41    0.307    6.63    4       21.4        1.4
  123   0   3   3 28.255  56.511   0.307    6.61    4       27.6        2.4
  124   1  11   0 28.424  56.848   0.309    6.52    4      124.1       47.5
  125   6   3  -1 28.569  57.139   0.31     6.44    4       15.2        0.7
  126   6   0   0 28.583  57.165   0.311    6.44    2      108.3       17.9
  127   5   5  -2 28.705  57.409   0.312    6.38    4       31.7        3.0
  128   4   1  -3 28.792  57.584   0.313    6.33    4       17.1        0.9
  129   1   9  -2 28.854  57.707   0.313    6.3     4       12.5        0.5
  130   1   0   3 28.924  57.848   0.314    6.27    2       13.0        0.3
  131   3   4  -3 28.97   57.939   0.314    6.25    4        8.4        0.2
  132   3   5   2 28.977  57.954   0.314    6.24    4       33.8        3.4
  133   6   2   0 29.076  58.153   0.315    6.19    4       32.2        3.0
  134   2   5  -3 29.267  58.534   0.317    6.1     4      186.5      100.5
  135   4   7   1 29.362  58.724   0.318    6.06    4       63.4       11.5
  136   1   2   3 29.414  58.828   0.319    6.03    4        2.8        0.0
  137   6   0  -2 29.462  58.923   0.319    6.01    2      124.5       22.1
  138   3  10  -1 29.499  58.998   0.32     6.0     4       58.1        9.6
  139   0  11   1 29.554  59.108   0.32     5.97    4        4.1        0.0
  140   5   4   1 29.615  59.229   0.321    5.94    4        2.8        0.0
  141   4   9  -1 29.721  59.441   0.322    5.9     4       14.0        0.5
  142   4   3  -3 29.77   59.54    0.322    5.87    4        2.4        0.0
  143   4   0   2 29.796  59.592   0.323    5.86    2      222.3       68.6
  144   5   7   0 29.876  59.752   0.323    5.83    4       15.3        0.6
  145   6   2  -2 29.946  59.892   0.324    5.8     4       32.1        2.8
  146   0   5   3 30.213  60.426   0.327    5.68    4       22.5        1.4
  147   4   2   2 30.278  60.555   0.327    5.66    4       14.2        0.5
  148   2  11  -1 30.363  60.726   0.328    5.62    4       30.2        2.4
  149   3   9  -2 30.481  60.962   0.329    5.57    4       91.4       22.0
  150   4   8  -2 30.504  61.008   0.329    5.56    4       12.0        0.4
  151   6   5  -1 30.514  61.029   0.33     5.56    4      103.2       28.0
  152   6   4   0 30.527  61.054   0.33     5.55    4       23.4        1.4
  153   1   9   2 30.613  61.225   0.331    5.52    4       40.0        4.2
  154   1   6  -3 30.643  61.286   0.331    5.51    4      213.7      119.0
  155   2   8   2 30.701  61.402   0.331    5.48    4       84.4       18.5
  156   0  12   0 30.792  61.585   0.332    5.45    2      217.6       61.1
  157   1   4   3 30.855  61.71    0.333    5.42    4       19.4        1.0
  158   5   8  -1 31.013  62.026   0.334    5.36    4       17.4        0.8
  159   5   0  -3 31.148  62.296   0.336    5.31    2       10.2        0.1
  160   3   6  -3 31.37   62.74    0.338    5.23    4       46.0        5.2
  161   6   4  -2 31.373  62.745   0.338    5.23    4       96.1       22.8
  162   2  10  -2 31.52   63.04    0.339    5.17    4       34.1        2.8
  163   0  10   2 31.584  63.169   0.34     5.15    4       66.5       10.8
  164   5   7  -2 31.587  63.174   0.34     5.15    4       38.0        3.5
  165   2   1   3 31.605  63.21    0.34     5.14    4       26.2        1.7
  166   5   2  -3 31.617  63.234   0.34     5.14    4       59.3        8.6
  167   4   5  -3 31.67   63.34    0.341    5.12    4       25.5        1.6
  168   4   4   2 31.695  63.39    0.341    5.11    4       85.5       17.7
  169   3  11   0 31.784  63.568   0.342    5.08    4       85.2       17.5
  170   3   7   2 31.844  63.689   0.342    5.06    4       11.7        0.3
  171   5   6   1 31.986  63.972   0.344    5.01    4      247.4      145.2
  172   2  11   1 32.072  64.144   0.345    4.98    4       55.3        7.2
  173   3  10   1 32.083  64.167   0.345    4.98    4       51.2        6.2
  174   2   7  -3 32.119  64.238   0.345    4.97    4       79.7       14.9
  175   4  10   0 32.185  64.37    0.346    4.94    4       69.4       11.3
  176   1  12  -1 32.26   64.52    0.346    4.92    4       28.4        1.9
  177   2  12   0 32.425  64.85    0.348    4.86    4       42.7        4.2
  178   7   0  -1 32.479  64.959   0.349    4.85    2        4.1        0.0
  179   2   3   3 32.532  65.064   0.349    4.83    4       70.2       11.3
  180   6   1   1 32.8    65.6     0.352    4.75    4       14.6        0.5
  181   6   6   0 32.86   65.721   0.352    4.73    4       16.8        0.6
  182   7   2  -1 32.938  65.876   0.353    4.7     4       62.3        8.6
  183   5   4  -3 33.002  66.004   0.354    4.68    4       11.8        0.3
  184   0   7   3 33.017  66.035   0.354    4.68    4       36.9        3.0
  185   1  12   1 33.093  66.186   0.354    4.66    4       34.4        2.6
  186   4   9   1 33.127  66.254   0.355    4.65    4       35.5        2.8
  187   1   6   3 33.175  66.351   0.355    4.63    4       19.1        0.8
  188   6   7  -1 33.304  66.608   0.356    4.59    4       31.0        2.1
  189   1  11  -2 33.565  67.13    0.359    4.52    4        5.4        0.1
  190   5   9   0 33.608  67.215   0.359    4.51    4        8.4        0.1
  191   6   6  -2 33.673  67.347   0.36     4.49    4       18.7        0.7
  192   6   3   1 33.709  67.419   0.36     4.48    4       41.1        3.6
  193   1   8  -3 33.879  67.758   0.362    4.43    4       12.4        0.3
  194   4   6   2 33.984  67.969   0.363    4.4     4        7.8        0.1
  195   7   1  -2 34.029  68.058   0.363    4.39    4      172.4       61.8
  196   7   1   0 34.041  68.083   0.363    4.39    4       77.1       12.3
  197   1  13   0 34.076  68.152   0.364    4.38    4       10.6        0.2
  198   7   4  -1 34.295  68.59    0.366    4.32    4       16.2        0.5
  199   2   5   3 34.346  68.693   0.366    4.31    4      107.7       23.6
  200   4  11  -1 34.363  68.726   0.366    4.3     4       19.3        0.8
  201   5   1   2 34.4    68.8     0.367    4.29    4       30.6        1.9
  202   4   7  -3 34.409  68.817   0.367    4.29    4       40.0        3.3
  203   6   1  -3 34.418  68.836   0.367    4.29    4        1.6        0.0
  204   3   8  -3 34.569  69.139   0.368    4.25    4        5.7        0.1
  205   3  12  -1 34.606  69.212   0.369    4.24    4       18.1        0.7
  206   4  10  -2 34.645  69.289   0.369    4.23    4       59.0        7.0
  207   3   0   3 34.722  69.444   0.37     4.21    2       15.9        0.3
  208   2  10   2 34.829  69.658   0.371    4.19    4       37.4        2.8
  209   7   3  -2 34.923  69.845   0.372    4.16    4       97.5       18.8
  210   7   3   0 34.935  69.87    0.372    4.16    4       57.3        6.5
  211   3  11  -2 35.068  70.136   0.373    4.13    4      130.9       33.5
  212   0  13   1 35.101  70.202   0.373    4.12    4       41.6        3.4
  213   5  10  -1 35.121  70.243   0.373    4.12    4       31.6        1.9
  214   5   8   1 35.156  70.312   0.374    4.11    4       28.5        1.6
  215   3   2   3 35.166  70.332   0.374    4.11    4       48.6        4.6
  216   1  11   2 35.19   70.38    0.374    4.1     4       95.8       17.8
  217   5   9  -2 35.22   70.44    0.374    4.09    4       12.4        0.3
  218   5   6  -3 35.248  70.496   0.375    4.09    4      120.9       28.3
  219   5   3   2 35.289  70.579   0.375    4.08    4       38.4        2.8
  220   6   3  -3 35.307  70.614   0.375    4.07    4        7.3        0.1
  221   3   9   2 35.464  70.927   0.377    4.04    4       74.9       10.7
  222   6   5   1 35.494  70.989   0.377    4.03    4      157.1       47.1
  223   2   9  -3 35.724  71.449   0.379    3.98    4       61.0        7.0
  224   2   0  -4 35.781  71.562   0.38     3.97    2       56.7        3.0
  225   2  13  -1 35.842  71.683   0.38     3.95    4       48.0        4.3
  226   6   8   0 35.992  71.985   0.381    3.92    4       78.0       11.3
  227   3   1  -4 36.213  72.426   0.383    3.87    4      137.7       34.8
  228   2   2  -4 36.219  72.439   0.384    3.87    4        5.1        0.0
  229   1   8   3 36.295  72.589   0.384    3.86    4        9.0        0.1
  230   1   1  -4 36.334  72.667   0.385    3.85    4       70.0        8.9
  231   2  12  -2 36.475  72.949   0.386    3.82    4      133.4       32.2
  232   3   4   3 36.484  72.969   0.386    3.82    4       12.1        0.3
  233   7   6  -1 36.504  73.008   0.386    3.82    4       93.9       15.9
  234   0  12   2 36.535  73.07    0.386    3.81    4      211.9       81.0
  235   0   9   3 36.58   73.159   0.387    3.8     4       58.3        6.1
  236   0  14   0 36.673  73.346   0.388    3.78    2       16.4        0.2
  237   7   5  -2 36.681  73.362   0.388    3.78    4       54.2        5.2
  238   7   5   0 36.693  73.387   0.388    3.78    4       10.5        0.2
  239   6   8  -2 36.773  73.547   0.389    3.76    4       19.9        0.7
  240   6   9  -1 36.854  73.708   0.389    3.75    4       15.6        0.4
  241   2   7   3 36.989  73.978   0.391    3.72    4       24.3        1.0
  242   3  12   1 37.001  74.002   0.391    3.72    4       13.5        0.3
  243   5   5   2 37.041  74.082   0.391    3.71    4       26.7        1.3
  244   6   5  -3 37.058  74.116   0.391    3.71    4       35.1        2.2
  245   4   8   2 37.073  74.145   0.391    3.71    4       48.9        4.2
  246   3   3  -4 37.084  74.168   0.391    3.7     4       79.8       11.2
  247   4  12   0 37.096  74.193   0.392    3.7     4       65.2        7.5
  248   3  13   0 37.155  74.311   0.392    3.69    4       19.6        0.7
  249   4   0  -4 37.185  74.369   0.392    3.69    2      129.3       14.6
  250   1   3  -4 37.204  74.407   0.392    3.68    4       56.6        5.6
  251   0   0   4 37.423  74.847   0.394    3.64    2      177.0       27.0
  252   2  13   1 37.423  74.847   0.394    3.64    4       30.1        1.6
  253   2   4  -4 37.523  75.046   0.395    3.63    4       39.2        2.6
  254   4  11   1 37.551  75.103   0.396    3.62    4        5.2        0.0
  255   4   2  -4 37.617  75.234   0.396    3.61    4        8.6        0.1
  256   1  10  -3 37.835  75.671   0.398    3.57    4       11.6        0.2
  257   0   2   4 37.855  75.709   0.398    3.57    4       14.6        0.4
  258   4   9  -3 37.913  75.826   0.399    3.56    4       36.6        2.3
  259   8   1  -1 37.994  75.989   0.4      3.54    4        9.5        0.2
  260   5  11   0 38.007  76.015   0.4      3.54    4       39.5        2.6
  261   1  14  -1 38.029  76.059   0.4      3.54    4       32.6        1.8
  262   7   0  -3 38.085  76.171   0.4      3.53    2        0.9        0.0
  263   6   7   1 38.104  76.208   0.401    3.53    4       69.7        8.1
  264   7   0   1 38.109  76.218   0.401    3.53    2        0.5        0.0
  265   2  14   0 38.183  76.366   0.401    3.51    4       34.0        1.9
  266   5   8  -3 38.294  76.588   0.402    3.5     4       12.3        0.3
  267   3  10  -3 38.496  76.993   0.404    3.46    4       56.1        5.2
  268   7   2  -3 38.514  77.028   0.404    3.46    4       60.4        6.0
  269   7   2   1 38.538  77.076   0.404    3.46    4       45.2        3.3
  270   3   6   3 38.643  77.285   0.405    3.44    4        8.5        0.1
  271   4   1   3 38.68   77.36    0.406    3.44    4        9.9        0.2
  272   3   5  -4 38.805  77.609   0.407    3.42    4       44.2        3.2
  273   1  14   1 38.807  77.614   0.407    3.42    4       50.0        4.0
  274   1  13  -2 38.823  77.647   0.407    3.42    4       66.0        7.0
  275   8   0  -2 38.851  77.701   0.407    3.41    2       86.8        6.1
  276   8   3  -1 38.851  77.702   0.407    3.41    4       30.8        1.5
  277   4   4  -4 38.904  77.807   0.408    3.4     4       23.9        0.9
  278   1   5  -4 38.922  77.845   0.408    3.4     4       11.0        0.2
  279   5  10   1 39.06   78.12    0.409    3.38    4       41.2        2.7
  280   5   1  -4 39.108  78.216   0.409    3.37    4       18.2        0.5
  281   0   4   4 39.139  78.278   0.41     3.37    4       45.9        3.4
  282   7   7  -2 39.262  78.524   0.411    3.35    4        4.6        0.0
  283   6   0   2 39.262  78.524   0.411    3.35    2       59.0        2.8
  284   7   7   0 39.274  78.547   0.411    3.35    4       36.0        2.1
  285   8   2  -2 39.277  78.554   0.411    3.35    4        1.9        0.0
  286   4  12  -2 39.421  78.843   0.412    3.33    4       28.6        1.3
  287   1   1   4 39.46   78.92    0.413    3.33    4       11.5        0.2
  288   7   8  -1 39.514  79.028   0.413    3.32    4       21.2        0.7
  289   4   3   3 39.532  79.064   0.413    3.32    4       11.1        0.2
  290   5  11  -2 39.547  79.094   0.413    3.31    4       15.8        0.4
  291   4  13  -1 39.579  79.157   0.414    3.31    4       32.7        1.7
  292   2  12   2 39.597  79.195   0.414    3.31    4       20.4        0.7
  293   5   7   2 39.614  79.227   0.414    3.3     4       22.2        0.8
  294   6   7  -3 39.631  79.261   0.414    3.3     4       21.5        0.7
  295   8   0   0 39.635  79.271   0.414    3.3     2      122.9       11.8
  296   2   6  -4 39.662  79.324   0.414    3.3     4        9.3        0.1
  297   6   2   2 39.687  79.374   0.415    3.29    4        8.1        0.1
  298   3  11   2 39.781  79.562   0.415    3.28    4      147.9       34.0
  299   7   4  -3 39.792  79.584   0.415    3.28    4        6.4        0.1
  300   7   4   1 39.816  79.631   0.416    3.28    4       23.8        0.9
  301   6  10   0 39.867  79.733   0.416    3.27    4       21.3        0.7
  302   5  12  -1 39.877  79.753   0.416    3.27    4       22.5        0.8
  303   5   3  -4 39.958  79.915   0.417    3.26    4       36.0        2.0
  304   2  11  -3 40.032  80.063   0.418    3.25    4       40.9        2.6
  305   8   2   0 40.059  80.119   0.418    3.25    4       14.2        0.3
  306   1  15   0 40.155  80.31    0.419    3.24    4       14.8        0.3
  307   1  10   3 40.159  80.318   0.419    3.24    4       19.8        0.6
  308   3  14  -1 40.233  80.466   0.419    3.23    4       39.0        2.3
  309   3  13  -2 40.249  80.498   0.419    3.22    4       32.2        1.6
  310   1   3   4 40.308  80.616   0.42     3.22    4       11.6        0.2
  311   1  13   2 40.366  80.731   0.42     3.21    4        8.3        0.1
  312   2   9   3 40.41   80.82    0.421    3.2     4       32.0        1.6
  313   8   4  -2 40.548  81.097   0.422    3.19    4        9.4        0.1
  314   8   5  -1 40.549  81.097   0.422    3.19    4       19.4        0.6
  315   6  10  -2 40.623  81.245   0.423    3.18    4       27.0        1.1
  316   0  11   3 40.857  81.714   0.425    3.15    4        0.8        0.0
  317   4  10   2 40.914  81.827   0.425    3.15    4       74.4        8.2
  318   6   4   2 40.955  81.911   0.425    3.14    4       93.8       13.1
  319   4   6  -4 41.022  82.045   0.426    3.14    4        2.1        0.0
  320   6  11  -1 41.122  82.245   0.427    3.13    4       23.8        0.8
  321   0  15   1 41.124  82.249   0.427    3.12    4       54.8        4.4
  322   4   5   3 41.223  82.446   0.428    3.11    4       43.9        2.8
  323   0   6   4 41.255  82.509   0.428    3.11    4        0.1        0.0
  324   8   4   0 41.325  82.65    0.429    3.1     4       10.5        0.2
  325   3   7  -4 41.345  82.691   0.429    3.1     4       17.2        0.4
  326   1   7  -4 41.461  82.923   0.43     3.09    4       16.0        0.4
  327   6   9   1 41.499  82.997   0.43     3.09    4       14.4        0.3
  328   6   0  -4 41.529  83.058   0.43     3.08    2      172.5       21.7
  329   3   8   3 41.606  83.213   0.431    3.08    4       11.6        0.2
  330   5   5  -4 41.644  83.289   0.431    3.07    4        0.9        0.0
  331   2  15  -1 41.83   83.659   0.433    3.05    4       58.9        5.0
  332   7   6  -3 41.9    83.8     0.434    3.05    4       83.8       10.1
  333   7   6   1 41.923  83.847   0.434    3.05    4       34.1        1.7
  334   6   2  -4 41.949  83.898   0.434    3.04    4       17.2        0.4
  335   1   5   4 41.992  83.983   0.434    3.04    4       20.3        0.6
  336   2   0   4 41.992  83.985   0.434    3.04    2        6.9        0.0
  337   2  14  -2 42.017  84.034   0.434    3.04    4       27.2        1.1
  338   0  14   2 42.075  84.149   0.435    3.03    4        7.6        0.1
  339   5  10  -3 42.104  84.208   0.435    3.03    4       60.2        5.2
  340   4  11  -3 42.151  84.303   0.436    3.02    4        2.0        0.0
  341   2   2   4 42.411  84.823   0.438    3.0     4       19.0        0.5
  342   1  12  -3 42.495  84.99    0.438    2.99    4       17.9        0.5
  343   3  14   1 42.524  85.048   0.439    2.99    4       22.7        0.7
  344   8   1  -3 42.582  85.164   0.439    2.99    4        1.0        0.0
  345   2   8  -4 42.61   85.22    0.439    2.99    4        3.5        0.0
  346   4  14   0 42.616  85.231   0.44     2.98    4       13.5        0.3
  347   7   9  -2 42.634  85.269   0.44     2.98    4       54.2        4.1
  348   4  13   1 42.638  85.275   0.44     2.98    4       17.9        0.5
  349   7   9   0 42.646  85.292   0.44     2.98    4      100.1       14.1
  350   8   6  -2 42.649  85.298   0.44     2.98    4       24.8        0.9
  351   5   9   2 42.98   85.961   0.443    2.96    4       27.9        1.1
  352   6   9  -3 42.997  85.994   0.443    2.95    4       28.9        1.2
  353   5   0   3 43.04   86.08    0.443    2.95    2        6.5        0.0
  354   0  16   0 43.045  86.09    0.443    2.95    2        2.6        0.0
  355   6   6   2 43.053  86.106   0.443    2.95    4       24.2        0.8
  356   8   7  -1 43.068  86.135   0.443    2.95    4       37.8        2.0
  357   5  13   0 43.08   86.161   0.443    2.95    4       68.5        6.6
  358   3  15   0 43.091  86.182   0.443    2.95    4        1.0        0.0
  359   3  12  -3 43.139  86.278   0.444    2.94    4       14.4        0.3
  360   6   4  -4 43.205  86.41    0.444    2.94    4       10.6        0.2
  361   7  10  -1 43.301  86.601   0.445    2.93    4       22.1        0.7
  362   2  15   1 43.35   86.7     0.446    2.93    4       24.2        0.8
  363   8   3  -3 43.418  86.837   0.446    2.92    4       59.1        4.8
  364   8   6   0 43.42   86.84    0.446    2.92    4       29.9        1.2
  365   5   2   3 43.458  86.916   0.446    2.92    4        1.4        0.0
  366   2   4   4 43.666  87.332   0.448    2.91    4       82.3        9.3
  367   5  12   1 43.69   87.38    0.448    2.9     4       17.3        0.4
  368   4   7   3 43.736  87.472   0.449    2.9     4       80.3        8.9
  369   9   0  -1 43.774  87.547   0.449    2.9     2       13.4        0.1
  370   4   8  -4 43.955  87.909   0.451    2.89    4       41.8        2.4
  371   8   1   1 44.123  88.245   0.452    2.88    4       16.8        0.4
  372   5   7  -4 44.155  88.309   0.452    2.87    4       24.7        0.8
  373   0   8   4 44.185  88.37    0.452    2.87    4        4.3        0.0
  374   9   2  -1 44.191  88.382   0.452    2.87    4       19.7        0.5
  375   1  16  -1 44.354  88.709   0.454    2.86    4       70.7        6.8
  376   9   1  -2 44.438  88.875   0.454    2.86    4       35.4        1.7
  377   6  12   0 44.482  88.964   0.455    2.86    4       36.7        1.8
  378   1   7   4 44.5    89.0     0.455    2.85    4       21.8        0.6
  379   2  16   0 44.503  89.007   0.455    2.85    4        5.1        0.0
  380   5  13  -2 44.585  89.17    0.456    2.85    4       60.6        5.0
  381   2  11   3 44.601  89.201   0.456    2.85    4       12.2        0.2
  382   3   9  -4 44.692  89.384   0.457    2.84    4       31.6        1.3
  383   5   4   3 44.71   89.42    0.457    2.84    4       14.3        0.3
  384   1  15  -2 44.711  89.421   0.457    2.84    4       32.8        1.5
  385   1  12   3 44.77   89.54    0.457    2.84    4       28.2        1.1
  386   1   9  -4 44.807  89.614   0.457    2.84    4        4.8        0.0
  387   3  13   2 44.815  89.63    0.458    2.84    4       49.9        3.3
  388   7   8  -3 44.826  89.652   0.458    2.84    4        5.9        0.0
  389   7   8   1 44.849  89.698   0.458    2.84    4       27.1        1.0
  390   7   1  -4 44.863  89.726   0.458    2.84    4       79.1        8.4
  391   4  14  -2 44.879  89.758   0.458    2.83    4        3.5        0.0
  392   7   1   2 44.898  89.796   0.458    2.83    4       61.3        5.0
  393   8   3   1 44.957  89.914   0.459    2.83    4       17.1        0.4


  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   4.894   9.789  9.028         11.4      2.3      2.4     5.6
    2   1   1   0   5.188  10.377  8.51776      119.8     24.5     24.9     5.6
    3   0   1   1   9.079  18.159  4.88134       60.1     12.3     12.5     5.6
    4   2   0   0   9.176  18.353  4.8301        25.5      5.2      5.3     5.6
    5   0   4   0   9.825  19.65   4.514        113.3     23.2     23.4     5.6
    6   2   1  -1  11.108  22.215  3.99827       92.0     18.8     19.0     5.6
    7   0   3   1  11.458  22.916  3.87764      106.8     21.9     22.0     5.6
    8   1   2   1  12.014  24.028  3.70053        6.4      1.3      1.3     5.6
    9   2   3  -1  13.139  26.279  3.38852      449.1     91.9     92.4     5.6
   10   1   4  -1  13.175  26.35   3.37956       12.3      2.5      2.5     5.6
   11   2   4   0  13.507  27.014  3.29797      335.1     68.6     68.9     5.6
   12   3   1   0  14.063  28.126  3.17005      297.9     61.0     61.2     5.6
   13   2   1   1  14.601  29.203  3.05552       52.9     10.8     10.9     5.6
   14   1   4   1  14.79   29.58   3.01741        5.1      1.1      1.1     5.6
   15   3   2  -1  15.088  30.176  2.9592       267.9     54.8     55.0     5.6
   16   0   5   1  15.181  30.363  2.94138       85.3     17.5     17.5     5.6
   17   3   3   0  15.741  31.483  2.83925       98.8     20.2     20.3     5.6
   18   2   3   1  16.229  32.459  2.75609      198.1     40.5     40.6     5.6
   19   2   5  -1  16.514  33.027  2.70994      488.5    100.0    100.0     5.6
   20   1   6  -1  17.291  34.583  2.5915       210.7     43.1     43.1     5.7
   21   2   0  -2  17.589  35.179  2.54897       39.0      8.0      8.0     5.7
   22   0   0   2  17.689  35.378  2.53507      367.7     75.3     75.1     5.7
   23   1   6   1  18.584  37.168  2.41699       21.8      4.5      4.5     5.7
   24   3   5   0  18.693  37.386  2.40336       54.1     11.1     11.0     5.7
   25   2   5   1  19.115  38.229  2.35229      241.0     49.3     49.1     5.7
   26   0   7   1  19.576  39.151  2.29901      135.9     27.8     27.7     5.7
   27   1   1   2  19.708  39.416  2.28417       90.6     18.5     18.4     5.7
   28   4   3  -1  19.801  39.602  2.27387        9.1      1.9      1.8     5.7
   29   0   8   0  19.955  39.91   2.257          5.0      1.0      1.0     5.7
   30   2   4  -2  20.307  40.613  2.21955        7.0      1.4      1.4     5.7
   31   0   4   2  20.395  40.79   2.21035       55.2     11.3     11.2     5.7
   32   2   7  -1  20.659  41.318  2.1833        22.7      4.6      4.6     5.7
   33   3   6  -1  20.791  41.582  2.17007      178.3     36.5     36.2     5.7
   34   1   3   2  20.987  41.975  2.15064       40.0      8.2      8.1     5.7
   35   1   5  -2  21.216  42.432  2.1285        25.7      5.3      5.2     5.7
   36   4   0  -2  22.07   44.14   2.05003       93.1     19.1     18.9     5.7
   37   2   8   0  22.13   44.26   2.04478        6.7      1.4      1.4     5.7
   38   2   0   2  22.317  44.634  2.02851       88.8     18.2     18.0     5.7
   39   3   7   0  22.496  44.992  2.01317       17.3      3.5      3.5     5.7
   40   1   9   0  23.088  46.175  1.96431       35.1      7.2      7.1     5.7
   41   5   2  -1  23.285  46.57   1.94856        8.8      1.8      1.8     5.7
   42   1   5   2  23.374  46.749  1.94155       31.3      6.4      6.3     5.7
   43   5   1   0  23.638  47.277  1.92107       65.5     13.4     13.2     5.7
   44   3   6   1  24.016  48.033  1.89258       22.0      4.5      4.4     5.7
   45   0   9   1  24.388  48.776  1.86549       59.4     12.2     12.0     5.7
   46   2   4   2  24.602  49.203  1.85027       19.2      3.9      3.9     5.7
   47   1   7  -2  24.702  49.404  1.84321        8.7      1.8      1.8     5.7
   48   5   3   0  24.754  49.508  1.83958       17.0      3.5      3.4     5.7
   49   0  10   0  25.252  50.505  1.8056        21.3      4.4      4.3     5.8
   50   2   9  -1  25.306  50.611  1.80206       16.8      3.4      3.4     5.8
   51   5   1  -2  25.623  51.245  1.78124        5.7      1.2      1.1     5.8
   52   3   1   2  25.916  51.833  1.76241       18.1      3.7      3.6     5.8
   53   3   7  -2  26.498  52.997  1.72642        5.2      1.1      1.0     5.8
   54   1  10  -1  26.909  53.818  1.702          6.5      1.3      1.3     5.8
   55   2   8  -2  27.119  54.239  1.68978       20.2      4.1      4.0     5.8
   56   0   8   2  27.19   54.38   1.68571       44.9      9.2      9.0     5.8
   57   2   3  -3  27.267  54.534  1.68134       44.7      9.1      8.9     5.8
   58   3   2  -3  27.468  54.936  1.66999       39.6      8.1      7.9     5.8
   59   5   6  -1  27.59   55.181  1.66314      153.1     31.3     30.6     5.8
   60   4   8   0  27.848  55.695  1.64899       34.3      7.0      6.9     5.8
   61   1  11   0  28.424  56.848  1.61826       47.5      9.7      9.5     5.8
   62   6   0   0  28.583  57.165  1.61003       17.9      3.7      3.6     5.8
   63   2   5  -3  29.267  58.534  1.57559      100.5     20.6     20.0     5.8
   64   4   7   1  29.362  58.724  1.57094       11.5      2.4      2.3     5.8
   65   6   0  -2  29.462  58.923  1.56612       22.1      4.5      4.4     5.8
   66   3  10  -1  29.499  58.998  1.5643         9.6      2.0      1.9     5.8
   67   4   0   2  29.796  59.592  1.55012       68.6     14.0     13.6     5.8
   68   3   9  -2  30.481  60.962  1.51853       22.4      4.6      4.4     5.8
   69   6   5  -1  30.514  61.029  1.51703       29.5      6.0      5.8     5.8
   70   1   6  -3  30.643  61.286  1.51129      119.0     24.4     23.6     5.8
   71   2   8   2  30.701  61.402  1.5087        18.5      3.8      3.7     5.8
   72   0  12   0  30.792  61.585  1.50467       61.1     12.5     12.1     5.8
   73   6   4  -2  31.373  62.745  1.4796        28.1      5.7      5.6     5.9
   74   0  10   2  31.584  63.169  1.47069       16.0      3.3      3.2     5.9
   75   5   2  -3  31.617  63.234  1.46933        8.6      1.8      1.7     5.9
   76   4   4   2  31.695  63.39   1.46608       19.2      3.9      3.8     5.9
   77   3  11   0  31.784  63.568  1.46241       17.5      3.6      3.4     5.9
   78   5   6   1  31.986  63.972  1.45415      145.2     29.7     28.6     5.9
   79   2  11   1  32.072  64.144  1.45067       13.4      2.7      2.6     5.9
   80   2   7  -3  32.119  64.238  1.44876       14.9      3.1      2.9     5.9
   81   4  10   0  32.185  64.37   1.44611       11.3      2.3      2.2     5.9
   82   2   3   3  32.532  65.064  1.43236       11.3      2.3      2.2     5.9
   83   7   2  -1  32.938  65.876  1.41666        8.6      1.8      1.7     5.9
   84   7   1  -2  34.029  68.058  1.37646       74.1     15.2     14.5     5.9
   85   2   5   3  34.346  68.693  1.36527       24.4      5.0      4.8     5.9
   86   4   7  -3  34.409  68.817  1.36311        5.2      1.1      1.0     5.9
   87   4  10  -2  34.645  69.289  1.35497        7.0      1.4      1.4     5.9
   88   7   3  -2  34.923  69.845  1.34554       25.2      5.2      4.9     5.9
   89   3  11  -2  35.068  70.136  1.34067       33.5      6.9      6.5     5.9
   90   0  13   1  35.101  70.202  1.33957        5.3      1.1      1.0     5.9
   91   1  11   2  35.19   70.38   1.33661       24.0      4.9      4.7     5.9
   92   5   6  -3  35.248  70.496  1.3347        28.3      5.8      5.5     5.9
   93   3   9   2  35.464  70.927  1.32764       10.7      2.2      2.1     5.9
   94   6   5   1  35.494  70.989  1.32664       47.1      9.6      9.2     5.9
   95   2   9  -3  35.724  71.449  1.31923        7.0      1.4      1.4     5.9
   96   6   8   0  35.992  71.985  1.31072       11.3      2.3      2.2     5.9
   97   3   1  -4  36.213  72.426  1.30381       34.8      7.1      6.8     5.9
   98   1   1  -4  36.334  72.667  1.30008        8.9      1.8      1.7     6.0
   99   2  12  -2  36.475  72.949  1.29575       48.4      9.9      9.4     6.0
  100   0  12   2  36.535  73.07   1.29391       81.0     16.6     15.7     6.0
  101   0   9   3  36.58   73.159  1.29255        6.1      1.2      1.2     6.0
  102   7   5  -2  36.681  73.362  1.28947        5.4      1.1      1.1     6.0
  103   4  12   0  37.096  74.193  1.27708       22.8      4.7      4.4     6.0
  104   4   0  -4  37.185  74.369  1.27448       20.2      4.1      3.9     6.0
  105   0   0   4  37.423  74.847  1.26753       28.6      5.8      5.5     6.0
  106   6   7   1  38.104  76.208  1.24824        8.1      1.7      1.6     6.0
  107   7   2  -3  38.514  77.028  1.23698       14.5      3.0      2.8     6.0
  108   1  13  -2  38.823  77.647  1.22867       21.9      4.5      4.2     6.0
  109   8   0   0  39.635  79.271  1.20752       11.9      2.4      2.3     6.0
  110   3  11   2  39.781  79.562  1.20384       34.1      7.0      6.5     6.0
  111   4  10   2  40.914  81.827  1.17615        8.2      1.7      1.6     6.1
  112   6   4   2  40.955  81.911  1.17515       13.1      2.7      2.5     6.1
  113   6   0  -4  41.529  83.058  1.16181       21.7      4.4      4.1     6.1
  114   2  15  -1  41.83   83.659  1.15499        5.0      1.0      0.9     6.1
  115   7   6  -3  41.9    83.8    1.1534        11.8      2.4      2.2     6.1
  116   5  10  -3  42.104  84.208  1.14885        5.2      1.1      1.0     6.1
  117   7   9   0  42.646  85.292  1.137         19.6      4.0      3.7     6.1
  118   5  13   0  43.08   86.161  1.12775        8.6      1.8      1.6     6.1
  119   8   3  -3  43.418  86.837  1.1207         6.1      1.2      1.1     6.1
  120   2   4   4  43.666  87.332  1.11562        9.7      2.0      1.8     6.2
  121   4   7   3  43.736  87.472  1.11419        8.9      1.8      1.7     6.2
  122   1  16  -1  44.354  88.709  1.10183        6.8      1.4      1.3     6.2
  123   5  13  -2  44.585  89.17   1.09732        5.2      1.1      1.0     6.2
  124   7   1  -4  44.863  89.726  1.09195        8.4      1.7      1.6     6.2
  125   7   1   2  44.898  89.796  1.09129        5.0      1.0      0.9     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)