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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POTASSICRICHTERITE

6, syn, K, f-amphiboles, sf-glaucophane, s-richterite

K(KCa)Mg(5)Si(8)O(22)(OH)(2)


Monoclinic  C 2/m  Z = 2

C2/m

28 .2 .1902

Ref.Str.:

         Yang H, Konzett J, Prewitt C T, Fei Y. (1999)

         * Amer. Mineral., 84, 681-684

Reserv:

         In original - richterite.     N.A.D.

                   Initial data from BDM-file 

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

             a =  10.1926   alpha =   90.0 
             b =  18.1209   beta  =  105.51
             c =   5.2736   gamma =   90.0 

    Unit cell volume (cub. angs.) =   938.54

    Molar volume ( cub.cm/mol.) =   282.66

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

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

   1 0.1083  0.0869  0.2204   0.0    O     = 1.00
   2 0.1175  0.1689  0.7298   0.0    O     = 1.00
   3 0.1038  0.0     0.7298   0.0    O     = 1.00
   4 0.3589  0.2463  0.8088   0.0    O     = 1.00
   5 0.3399  0.1289  0.1057   0.0    O     = 1.00
   6 0.3339  0.1145  0.605    0.0    O     = 1.00
   7 0.3271  0.0     0.3047   0.0    O     = 1.00
   8 0.2706  0.0847  0.3065   0.0    Si    = 1.00
   9 0.2812  0.1708  0.8131   0.0    Si    = 1.00
  10 0.0     0.0889  0.5      0.0    Mg    = 1.00
  11 0.0     0.18    0.0      0.0    Mg    = 1.00
  12 0.0     0.0     0.0      0.0    Mg    = 1.00
  13 0.0     0.2819  0.5      0.0    K     = 0.5 , Ca    = 0.5 
  14 0.013   0.5     0.028    0.0    K     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.1083     0.0869     0.2204
     2       2     0.1175     0.1689     0.7298
     3       3     0.1038     0.0        0.7298
     4       4     0.3589     0.2463     0.8088
     5       5     0.3399     0.1289     0.1057
     6       6     0.3339     0.1145     0.605 
     7       7     0.3271     0.0        0.3047
     8       8     0.2706     0.0847     0.3065
     9       9     0.2812     0.1708     0.8131
    10      10     0.0        0.0889     0.5   
    11      11     0.0        0.18       0.0   
    12      12     0.0        0.0        0.0   
    13      13     0.0        0.2819     0.5   
    14      14     0.013      0.5        0.028 
    15       1     0.8917     0.9131     0.7796
    16       2     0.8825     0.8311     0.2702
    17       3     0.8962     0.0        0.2702
    18       4     0.6411     0.7537     0.1912
    19       5     0.6601     0.8711     0.8943
    20       6     0.6661     0.8855     0.395 
    21       7     0.6729     0.0        0.6953
    22       8     0.7294     0.9153     0.6935
    23       9     0.7188     0.8292     0.1869
    24      10     0.0        0.9111     0.5   
    25      11     0.0        0.82       0.0   
    26      13     0.0        0.7181     0.5   
    27      14     0.987      0.5        0.972 
    28       1     0.1083     0.9131     0.2204
    29       2     0.1175     0.8311     0.7298
    30       4     0.3589     0.7537     0.8088
    31       5     0.3399     0.8711     0.1057
    32       6     0.3339     0.8855     0.605 
    33       8     0.2706     0.9153     0.3065
    34       9     0.2812     0.8292     0.8131
    35       1     0.8917     0.0869     0.7796
    36       2     0.8825     0.1689     0.2702
    37       4     0.6411     0.2463     0.1912
    38       5     0.6601     0.1289     0.8943
    39       6     0.6661     0.1145     0.395 
    40       8     0.7294     0.0847     0.6935
    41       9     0.7188     0.1708     0.1869
    42       1     0.6083     0.4131     0.2204
    43       2     0.6175     0.3311     0.7298
    44       3     0.6038     0.5        0.7298
    45       4     0.8589     0.2537     0.8088
    46       5     0.8399     0.3711     0.1057
    47       6     0.8339     0.3855     0.605 
    48       7     0.8271     0.5        0.3047
    49       8     0.7706     0.4153     0.3065
    50       9     0.7812     0.3292     0.8131
    51      10     0.5        0.4111     0.5   
    52      11     0.5        0.32       0.0   
    53      12     0.5        0.5        0.0   
    54      13     0.5        0.2181     0.5   
    55      14     0.513      0.0        0.028 
    56       1     0.3917     0.5869     0.7796
    57       2     0.3825     0.6689     0.2702
    58       3     0.3962     0.5        0.2702
    59       4     0.1411     0.7463     0.1912
    60       5     0.1601     0.6289     0.8943
    61       6     0.1661     0.6145     0.395 
    62       7     0.1729     0.5        0.6953
    63       8     0.2294     0.5847     0.6935
    64       9     0.2188     0.6708     0.1869
    65      10     0.5        0.5889     0.5   
    66      11     0.5        0.68       0.0   
    67      13     0.5        0.7819     0.5   
    68      14     0.487      0.0        0.972 
    69       1     0.6083     0.5869     0.2204
    70       2     0.6175     0.6689     0.7298
    71       4     0.8589     0.7463     0.8088
    72       5     0.8399     0.6289     0.1057
    73       6     0.8339     0.6145     0.605 
    74       8     0.7706     0.5847     0.3065
    75       9     0.7812     0.6708     0.8131
    76       1     0.3917     0.4131     0.7796
    77       2     0.3825     0.3311     0.2702
    78       4     0.1411     0.2537     0.1912
    79       5     0.1601     0.3711     0.8943
    80       6     0.1661     0.3855     0.395 
    81       8     0.2294     0.4153     0.6935
    82       9     0.2188     0.3292     0.1869


X-ray density (g/cm cub.)   =      3.14

MU (1/cm) =     162.681    Mass attenuation coefficient (cm**2/g) =     51.815

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

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

    1    O                   3.264       12
                                                 3.0494       2
                                                 3.0067       2
                                                 3.1248       3
                                                 3.0186       3
                                                 2.6984       5
                                                 2.6751       6
                                                 2.6684       7
                                                 2.7434       3
                                                 3.1494       1
                                                 2.7445       1
                                                 2.8102       2
                                                 3.0494       4
    2    O                   3.264       10
                                                 3.0067       1
                                                 3.0494       1
                                                 3.0638       3
                                                 2.7652       4
                                                 2.6814       5
                                                 2.6545       6
                                                 2.8102       1
                                                 2.9165       2
                                                 3.1733       4
                                                 2.8331       4
    3    O                   3.264        9
                                                 3.0186       1
                                                 3.1248       1
                                                 3.0638       2
                                                 2.7434       1
                                                 2.7583       3
                                                 3.0186       1
                                                 3.1248       1
                                                 3.0638       2
                                                 2.7434       1
    4    O                   3.264        8
                                                 2.7652       2
                                                 2.679        5
                                                 2.6034       6
                                                 3.0393       4
                                                 3.1733       2
                                                 3.0494       1
                                                 2.8331       2
                                                 3.1484       5
    5    O                   3.264        7
                                                 2.6984       1
                                                 2.6814       2
                                                 2.679        4
                                                 2.6629       6
                                                 2.6377       6
                                                 2.5783       7
                                                 3.1484       4
    6    O                   3.264        6
                                                 2.6751       1
                                                 2.6545       2
                                                 2.6034       4
                                                 2.6377       5
                                                 2.6629       5
                                                 2.5998       7
    7    O                   3.264        6
                                                 2.6684       1
                                                 2.5783       5
                                                 2.5998       6
                                                 2.6684       1
                                                 2.5783       5
                                                 2.5998       6
    8    Si                  2.1          4
                                                 1.5945       1
                                                 1.6315       5
                                                 1.6256       6
                                                 1.6402       7
    9    Si                  2.1          4
                                                 1.6081       2
                                                 1.584        4
                                                 1.6798       5
                                                 1.6879       6
   10    Mg                  2.52         6
                                                 2.0651       1
                                                 2.0562       2
                                                 2.1207       3
                                                 2.1207       3
                                                 2.0651       1
                                                 2.0562       2
   11    Mg                  2.52         6
                                                 2.1747       1
                                                 2.1019       2
                                                 2.1747       1
                                                 2.1019       2
                                                 2.0231       4
                                                 2.0231       4
   12    Mg                  2.52         6
                                                 2.0887       1
                                                 1.989        3
                                                 2.0887       1
                                                 1.989        3
                                                 2.0887       1
                                                 2.0887       1
   13   K    ,Ca             3.228        8
                                                 2.5139       2
                                                 2.5139       2
                                                 2.4969       4
                                                 2.79         5
                                                 2.683        6
                                                 2.4969       4
                                                 2.79         5
                                                 2.683        6
   14    K                   3.228        8
                                                 3.0205       5
                                                 2.683        7
                                                 2.9608       5
                                                 2.9783       6
                                                 2.6952       7
                                                 3.0205       5
                                                 2.9608       5
                                                 2.9783       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  4.877   9.754   0.055  273.73    2       13.1       10.6
    2   1   1   0  5.118  10.236   0.058  248.34    4        1.8        0.4
    3   1   3   0  8.61   17.22    0.097   86.29    4       27.9       30.5
    4   0   0   1  8.719  17.438   0.098   84.1     2       33.8       21.8
    5   1   1  -1  9.019  18.039   0.102   78.45    4        7.4        2.0
    6   2   0   0  9.025  18.049   0.102   78.35    2        0.1        0.0
    7   0   4   0  9.79   19.579   0.11    66.26    2       45.2       30.7
    8   0   2   1 10.009  20.018   0.113   63.3     4       35.1       35.4
    9   2   2   0 10.278  20.555   0.116   59.92    4       22.1       13.2
   10   2   0  -1 10.761  21.523   0.121   54.46    2       32.7       13.2
   11   1   1   1 11.135  22.27    0.125   50.73    4       89.7      185.4
   12   1   3  -1 11.395  22.789   0.128   48.35    4       21.8       10.5
   13   2   2  -1 11.839  23.678   0.133   44.63    4       80.4      131.1
   14   1   5   0 13.094  26.188   0.147   36.11    4       72.4       85.9
   15   1   3   1 13.149  26.299   0.148   35.79    4      206.7      694.1
   16   0   4   1 13.167  26.334   0.148   35.69    4       58.9       56.3
   17   2   4   0 13.376  26.751   0.15    34.52    4      192.7      582.1
   18   3   1   0 13.833  27.667   0.155   32.15    4      102.7      154.0
   19   2   0   1 14.215  28.431   0.159   30.34    2        7.7        0.4
   20   3   1  -1 14.307  28.614   0.16    29.92    4       97.0      127.9
   21   2   4  -1 14.628  29.255   0.164   28.54    4       44.8       26.0
   22   0   6   0 14.776  29.553   0.166   27.93    2       41.4       10.8
   23   2   2   1 15.062  30.124   0.169   26.81    4      196.0      467.4
   24   1   5  -1 15.109  30.218   0.169   26.63    4       99.0      118.5
   25   3   3   0 15.523  31.046   0.174   25.13    4      113.0      145.7
   26   3   3  -1 15.951  31.902   0.178   23.7     4      194.9      408.6
   27   1   5   1 16.5    33.0     0.184   22.02    4      203.8      415.3
   28   1   1  -2 17.17   34.341   0.192   20.2     4       67.1       41.3
   29   0   6   1 17.259  34.518   0.193   19.97    4      198.9      358.9
   30   2   4   1 17.379  34.758   0.194   19.67    4       44.2       17.5
   31   2   6   0 17.423  34.846   0.194   19.56    4       56.9       28.7
   32   2   0  -2 17.565  35.131   0.196   19.22    2      333.8      486.2
   33   0   0   2 17.648  35.297   0.197   19.02    2       54.2       12.7
   34   1   7   0 17.922  35.843   0.2     18.39    4       34.8       10.1
   35   4   0  -1 18.046  36.091   0.201   18.12    2       18.0        1.3
   36   2   2  -2 18.273  36.545   0.204   17.63    4       11.0        1.0
   37   4   0   0 18.284  36.567   0.204   17.6     2      118.1       55.8
   38   0   2   2 18.353  36.706   0.204   17.46    4       10.2        0.8
   39   3   1   1 18.361  36.722   0.204   17.44    4       12.7        1.3
   40   2   6  -1 18.427  36.853   0.205   17.3     4       31.2        7.6
   41   3   5   0 18.486  36.972   0.206   17.18    4      134.4      140.9
   42   1   3  -2 18.588  37.176   0.207   16.98    4       29.7        6.8
   43   4   2  -1 18.737  37.474   0.209   16.68    4      158.8      191.0
   44   3   5  -1 18.854  37.708   0.21    16.45    4      116.1      100.7
   45   4   2   0 18.968  37.935   0.211   16.23    4       29.8        6.5
   46   3   1  -2 19.454  38.908   0.216   15.35    4       84.9       50.2
   47   1   7  -1 19.489  38.978   0.217   15.29    4      181.7      229.3
   48   1   1   2 19.606  39.212   0.218   15.09    4       30.7        6.5
   49   3   3   1 19.704  39.409   0.219   14.92    4       77.7       40.9
   50   0   8   0 19.881  39.761   0.221   14.63    2       67.7       15.2
   51   2   4  -2 20.267  40.534   0.225   14.02    4      142.7      129.6
   52   0   4   2 20.34   40.681   0.226   13.9     4       83.3       43.9
   53   1   7   1 20.621  41.241   0.229   13.49    4        9.7        0.6
   54   4   4  -1 20.694  41.387   0.229   13.38    4       36.6        8.2
   55   2   6   1 20.735  41.471   0.23    13.32    4      214.9      279.2
   56   3   3  -2 20.738  41.475   0.23    13.32    4      108.2       70.8
   57   1   3   2 20.882  41.763   0.231   13.11    4       13.1        1.0
   58   4   4   0 20.906  41.812   0.232   13.08    4       44.5       11.8
   59   1   5  -2 21.178  42.357   0.235   12.7     4      126.9       92.9
   60   0   8   1 21.859  43.717   0.242   11.83    4       47.5       12.1
   61   4   0  -2 21.928  43.855   0.242   11.75    2      202.3      109.2
   62   2   8   0 21.993  43.986   0.243   11.67    4       51.1       13.8
   63   2   0   2 22.134  44.268   0.245   11.5     2      242.1      153.1
   64   3   5   1 22.186  44.372   0.245   11.44    4       82.3       35.2
   65   3   7   0 22.293  44.586   0.246   11.32    4       38.2        7.5
   66   4   2  -2 22.519  45.038   0.249   11.07    4       14.2        1.0
   67   5   1  -1 22.526  45.052   0.249   11.06    4        7.0        0.2
   68   4   0   1 22.532  45.064   0.249   11.05    2        7.2        0.1
   69   3   7  -1 22.609  45.219   0.25    10.97    4       21.8        2.4
   70   2   2   2 22.721  45.442   0.251   10.84    4       19.0        1.8
   71   2   8  -1 22.827  45.654   0.252   10.73    4       51.5       12.9
   72   1   9   0 22.987  45.975   0.253   10.56    4      135.7       88.3
   73   4   2   1 23.111  46.222   0.255   10.44    4        4.7        0.1
   74   3   5  -2 23.129  46.257   0.255   10.42    4      125.4       74.4
   75   5   1   0 23.232  46.463   0.256   10.31    4      165.0      127.5
   76   1   5   2 23.261  46.521   0.256   10.28    4       13.7        0.9
   77   2   6  -2 23.274  46.548   0.256   10.27    4       40.6        7.7
   78   0   6   2 23.34   46.68    0.257   10.2     4       36.9        6.3
   79   4   6  -1 23.657  47.314   0.26     9.9     4      133.5       80.2
   80   5   3  -1 23.674  47.347   0.261    9.88    4       55.9       14.0
   81   4   6   0 23.848  47.696   0.262    9.72    4       41.7        7.7
   82   4   4  -2 24.225  48.45    0.266    9.38    4       82.5       29.0
   83   1   9  -1 24.284  48.567   0.267    9.33    4       84.7       30.4
   84   5   3   0 24.353  48.707   0.268    9.27    4       46.3        9.0
   85   2   4   2 24.416  48.833   0.268    9.21    4       30.5        3.9
   86   1   7  -2 24.645  49.29    0.271    9.02    4       32.5        4.3
   87   4   4   1 24.786  49.571   0.272    8.9     4       47.5        9.1
   88   2   8   1 24.8    49.601   0.272    8.89    4       49.6        9.9
   89   0  10   0 25.156  50.311   0.276    8.61    2      165.7       53.7
   90   1   9   1 25.242  50.483   0.277    8.54    4       85.5       28.4
   91   5   1  -2 25.394  50.788   0.278    8.42    4       21.8        1.8
   92   3   7   1 25.546  51.091   0.28     8.31    4       51.6       10.1
   93   3   1   2 25.64   51.28    0.281    8.24    4       73.4       20.2
   94   5   5  -1 25.852  51.703   0.283    8.09    4       13.8        0.7
   95   2   0  -3 26.079  52.157   0.285    7.93    2       16.9        0.5
   96   1   1  -3 26.255  52.509   0.287    7.81    4       61.7       13.5
   97   3   7  -2 26.397  52.793   0.289    7.71    4       13.5        0.6
   98   5   3  -2 26.447  52.895   0.289    7.68    4        0.6        0.0
   99   5   5   0 26.49   52.98    0.29     7.65    4       61.4       13.1
  100   1   7   2 26.517  53.033   0.29     7.63    4       56.8       11.2
  101   2   2  -3 26.599  53.199   0.291    7.58    4       15.3        0.8
  102   3   3   2 26.686  53.373   0.292    7.52    4        7.8        0.2
  103   3   9   0 26.688  53.376   0.292    7.52    4       38.7        5.1
  104   0  10   1 26.827  53.654   0.293    7.43    4       30.5        3.1
  105   4   6  -2 26.886  53.772   0.294    7.4     4       31.8        3.4
  106   2  10   0 26.943  53.885   0.294    7.36    4       91.0       27.7
  107   3   9  -1 26.965  53.931   0.294    7.35    4       91.6       28.0
  108   6   0  -1 27.011  54.022   0.295    7.32    2       23.5        0.9
  109   2   8  -2 27.043  54.087   0.295    7.3     4       68.8       15.7
  110   3   1  -3 27.044  54.089   0.295    7.3     4       10.3        0.4
  111   0   0   3 27.049  54.099   0.295    7.3     2       11.1        0.2
  112   2   6   2 27.064  54.127   0.295    7.29    4       30.6        3.1
  113   0   8   2 27.102  54.205   0.296    7.26    4       67.1       14.9
  114   1   3  -3 27.285  54.569   0.298    7.15    4      151.8       74.9
  115   5   1   1 27.301  54.601   0.298    7.14    4       37.3        4.5
  116   4   8  -1 27.387  54.774   0.299    7.09    4       34.8        3.9
  117   4   6   1 27.407  54.815   0.299    7.08    4      252.0      204.3
  118   6   2  -1 27.52   55.039   0.3      7.02    4       16.1        0.8
  119   0   2   3 27.557  55.115   0.3      6.99    4      165.9       87.5
  120   4   8   0 27.559  55.119   0.3      6.99    4       92.8       27.3
  121   2  10  -1 27.664  55.327   0.301    6.93    4       38.4        4.7
  122   3   3  -3 28.054  56.109   0.305    6.72    4       14.1        0.6
  123   6   0   0 28.072  56.144   0.305    6.71    2      146.4       32.6
  124   2   4  -3 28.121  56.243   0.306    6.68    4       56.4        9.7
  125   1  11   0 28.302  56.604   0.308    6.58    4      115.7       40.0
  126   5   3   1 28.304  56.609   0.308    6.58    4       62.1       11.5
  127   5   5  -2 28.472  56.944   0.309    6.49    4        7.8        0.2
  128   6   2   0 28.568  57.136   0.31     6.45    4       18.6        1.0
  129   4   0  -3 28.584  57.167   0.311    6.44    2       40.4        2.4
  130   3   5   2 28.7    57.399   0.312    6.38    4       69.4       13.9
  131   1   9  -2 28.774  57.548   0.312    6.34    4       16.5        0.8
  132   5   7  -1 28.896  57.792   0.314    6.28    4      128.1       46.8
  133   1   1   3 28.919  57.838   0.314    6.27    4       12.9        0.5
  134   6   4  -1 29.009  58.018   0.315    6.23    4       17.5        0.9
  135   0   4   3 29.046  58.091   0.315    6.21    4       24.8        1.7
  136   4   2  -3 29.074  58.148   0.315    6.19    4       57.3        9.2
  137   6   0  -2 29.135  58.27    0.316    6.17    2      291.7      119.2
  138   1   5  -3 29.27   58.54    0.317    6.1     4      177.4       87.2
  139   2  10   1 29.401  58.801   0.319    6.04    4       81.8       18.4
  140   4   0   2 29.415  58.83    0.319    6.03    2      177.6       43.2
  141   1  11  -1 29.428  58.856   0.319    6.03    4       36.0        3.6
  142   5   7   0 29.489  58.979   0.32     6.0     4       16.5        0.7
  143   3   9   1 29.587  59.173   0.32     5.96    4        1.1        0.0
  144   6   2  -2 29.619  59.239   0.321    5.94    4       41.7        4.7
  145   1   3   3 29.887  59.775   0.323    5.82    4       50.7        6.8
  146   4   2   2 29.897  59.794   0.324    5.82    4       21.5        1.2
  147   3   5  -3 30.007  60.013   0.325    5.77    4       24.7        1.6
  148   6   4   0 30.024  60.047   0.325    5.76    4       72.0       13.6
  149   5   5   1 30.246  60.493   0.327    5.67    4      106.3       29.1
  150   1  11   1 30.272  60.545   0.327    5.66    4       62.5       10.0
  151   4   8  -2 30.336  60.672   0.328    5.63    4      124.3       39.5
  152   3   9  -2 30.361  60.722   0.328    5.62    4      108.1       29.8
  153   1   9   2 30.471  60.941   0.329    5.58    4      146.1       54.1
  154   2   8   2 30.5    61.001   0.329    5.56    4       13.2        0.4
  155   4   4  -3 30.515  61.029   0.33     5.56    4       51.2        6.6
  156   2   6  -3 30.546  61.092   0.33     5.55    4      286.3      206.5
  157   0  12   0 30.67   61.34    0.331    5.5     2      261.1       85.1
  158   4   8   1 30.819  61.638   0.333    5.44    4        9.6        0.2
  159   6   4  -2 31.045  62.089   0.335    5.35    4       51.4        6.4
  160   5   1  -3 31.112  62.224   0.335    5.32    4       56.8        7.8
  161   2   0   3 31.279  62.557   0.337    5.26    2        6.6        0.1
  162   4   4   2 31.314  62.629   0.337    5.25    4      146.7       51.3
  163   5   7  -2 31.347  62.695   0.338    5.24    4       16.8        0.7
  164   6   6  -1 31.391  62.782   0.338    5.22    4      282.5      189.2
  165   2  10  -2 31.421  62.841   0.338    5.21    4      104.5       25.8
  166   0   6   3 31.426  62.852   0.338    5.21    4       67.8       10.9
  167   0  10   2 31.474  62.949   0.339    5.19    4       77.0       14.0
  168   3   7   2 31.562  63.125   0.34     5.16    4       25.3        1.5
  169   3  11   0 31.564  63.128   0.34     5.16    4       64.8        9.8
  170   4  10  -1 31.734  63.468   0.341    5.1     4       68.7       10.9
  171   2   2   3 31.743  63.487   0.342    5.09    4       34.2        2.7
  172   1   5   3 31.77   63.54    0.342    5.09    4       20.9        1.0
  173   3  11  -1 31.814  63.627   0.342    5.07    4      104.7       25.2
  174   4  10   0 31.891  63.783   0.343    5.04    4      118.8       32.3
  175   5   3  -3 32.041  64.081   0.344    4.99    4      117.2       31.1
  176   7   1  -1 32.055  64.11    0.345    4.99    4       46.6        4.9
  177   1   7  -3 32.102  64.204   0.345    4.97    4       37.9        3.2
  178   6   0   1 32.113  64.225   0.345    4.97    2        4.1        0.0
  179   0  12   1 32.15   64.3     0.345    4.96    4       76.9       13.3
  180   2  12   0 32.254  64.507   0.346    4.92    4       33.5        2.5
  181   6   6   0 32.361  64.722   0.347    4.89    4       42.9        4.1
  182   6   2   1 32.571  65.142   0.349    4.82    4       99.6       21.7
  183   5   9  -1 32.666  65.332   0.35     4.79    4       37.9        3.1
  184   3   7  -3 32.801  65.602   0.352    4.75    4       68.4       10.1
  185   4   6  -3 32.832  65.664   0.352    4.74    4       32.3        2.2
  186   2  12  -1 32.901  65.803   0.353    4.71    4       87.5       16.4
  187   7   3  -1 32.969  65.937   0.353    4.69    4       94.2       18.9
  188   5   7   1 33.029  66.059   0.354    4.68    4        5.6        0.1
  189   2   4   3 33.116  66.232   0.355    4.65    4       26.6        1.5
  190   5   9   0 33.22   66.44    0.356    4.62    4       49.3        5.1
  191   6   6  -2 33.341  66.683   0.357    4.58    4       49.6        5.1
  192   7   1   0 33.412  66.824   0.357    4.56    4       55.0        6.3
  193   1  11  -2 33.459  66.919   0.358    4.55    4       45.4        4.3
  194   7   1  -2 33.591  67.182   0.359    4.51    4       27.6        1.6
  195   4   6   2 33.601  67.203   0.359    4.51    4       57.1        6.7
  196   2   8  -3 33.765  67.529   0.361    4.46    4       19.6        0.8
  197   5   5  -3 33.856  67.711   0.362    4.44    4      100.5       20.4
  198   5   1   2 33.901  67.803   0.362    4.43    4      173.4       60.4
  199   6   4   1 33.926  67.851   0.362    4.42    4       44.8        4.0
  200   1  13   0 33.927  67.854   0.362    4.42    4       15.1        0.5
  201   6   0  -3 34.066  68.133   0.364    4.38    2        2.4        0.0
  202   3  11   1 34.207  68.415   0.365    4.34    4       60.3        7.2
  203   7   3   0 34.307  68.614   0.366    4.32    4       80.9       12.8
  204   4  10  -2 34.459  68.918   0.367    4.28    4       95.1       17.6
  205   2  12   1 34.481  68.961   0.367    4.27    4       64.2        8.0
  206   7   3  -2 34.484  68.967   0.368    4.27    4        7.7        0.1
  207   1   7   3 34.485  68.971   0.368    4.27    4       82.4       13.2
  208   6   2  -3 34.511  69.023   0.368    4.27    4       85.6       14.2
  209   3   1   3 34.524  69.049   0.368    4.26    4       25.3        1.2
  210   6   8  -1 34.567  69.134   0.368    4.25    4        2.5        0.0
  211   0   8   3 34.6    69.2     0.369    4.24    4       35.6        2.4
  212   2  10   2 34.612  69.225   0.369    4.24    4      114.4       25.2
  213   7   5  -1 34.759  69.518   0.37     4.2     4      193.6       71.5
  214   5   3   2 34.79   69.581   0.37     4.2     4      123.1       28.9
  215   4  10   1 34.911  69.822   0.371    4.17    4       18.1        0.6
  216   3  11  -2 34.924  69.849   0.372    4.16    4      115.8       25.4
  217   1  13  -1 34.948  69.896   0.372    4.16    4        8.5        0.1
  218   5   9  -2 34.967  69.935   0.372    4.15    4      114.3       24.6
  219   1  11   2 35.026  70.053   0.373    4.14    4      120.7       27.4
  220   3   9   2 35.171  70.342   0.374    4.1     4       28.4        1.5
  221   2   6   3 35.343  70.685   0.375    4.06    4      162.0       48.5
  222   3   3   3 35.406  70.812   0.376    4.05    4       21.1        0.8
  223   6   8   0 35.492  70.985   0.377    4.03    4      125.6       28.9
  224   1   9  -3 35.683  71.366   0.379    3.99    4       80.5       11.7
  225   1  13   1 35.72   71.441   0.379    3.98    4       82.3       12.2
  226   2   0  -4 35.752  71.504   0.379    3.97    2       28.1        0.7
  227   6   4  -3 35.831  71.661   0.38     3.96    4       33.1        2.0
  228   4   8  -3 35.943  71.886   0.381    3.93    4       57.9        6.0
  229   7   5   0 36.066  72.132   0.382    3.91    4       42.6        3.2
  230   6   6   1 36.129  72.258   0.383    3.89    4       73.2        9.5
  231   3   1  -4 36.181  72.363   0.383    3.88    4      137.9       33.5
  232   2   2  -4 36.188  72.375   0.383    3.88    4       14.9        0.4
  233   7   5  -2 36.239  72.477   0.384    3.87    4       99.8       17.5
  234   1   1  -4 36.282  72.563   0.384    3.86    4      140.6       34.7
  235   2  12  -2 36.348  72.695   0.385    3.85    4      248.8      108.2
  236   3   9  -3 36.349  72.697   0.385    3.85    4       47.7        4.0
  237   0  12   2 36.398  72.796   0.385    3.84    4      126.7       28.0
  238   6   8  -2 36.432  72.864   0.385    3.83    4       55.3        5.3
  239   5   7  -3 36.495  72.99    0.386    3.82    4       20.2        0.7
  240   0  14   0 36.52   73.041   0.386    3.81    2       19.4        0.3
  241   5   5   2 36.539  73.078   0.386    3.81    4       97.5       16.4
  242   5   9   1 36.566  73.132   0.387    3.8     4        2.2        0.0
  243   4  12  -1 36.64   73.28    0.387    3.79    4       56.5        5.5
  244   4   8   2 36.682  73.364   0.388    3.78    4        0.5        0.0
  245   4  12   0 36.787  73.575   0.389    3.76    4       91.1       14.2
  246   3  13   0 36.913  73.827   0.39     3.74    4       54.3        5.0
  247   3   3  -4 37.046  74.093   0.391    3.71    4       67.5        7.7
  248   5  11  -1 37.084  74.169   0.391    3.7     4       33.4        1.9
  249   4   0  -4 37.127  74.254   0.392    3.7     2      222.4       41.5
  250   3   5   3 37.143  74.286   0.392    3.69    4       19.8        0.7
  251   3  13  -1 37.146  74.292   0.392    3.69    4       70.6        8.4
  252   1   3  -4 37.146  74.292   0.392    3.69    4      107.4       19.3
  253   8   0  -1 37.214  74.429   0.393    3.68    2       13.2        0.1
  254   0   0   4 37.326  74.651   0.394    3.66    2      153.2       19.5
  255   7   7  -1 37.371  74.741   0.394    3.65    4       59.2        5.8
  256   2   4  -4 37.482  74.964   0.395    3.63    4       47.7        3.7
  257   7   1   1 37.508  75.015   0.395    3.63    4        9.2        0.1
  258   4   2  -4 37.557  75.113   0.396    3.62    4        4.0        0.0
  259   5  11   0 37.608  75.217   0.396    3.61    4       59.6        5.8
  260   8   2  -1 37.643  75.287   0.396    3.6     4       79.9       10.4
  261   2  10  -3 37.699  75.397   0.397    3.59    4        9.7        0.2
  262   0   2   4 37.754  75.509   0.397    3.59    4       11.7        0.2
  263   7   1  -3 37.848  75.696   0.398    3.57    4       19.0        0.6
  264   0  14   1 37.887  75.775   0.399    3.56    4       28.2        1.3
  265   1   9   3 37.962  75.924   0.399    3.55    4       20.3        0.7
  266   2  14   0 37.984  75.967   0.399    3.55    4       89.4       12.9
  267   6   6  -3 37.987  75.974   0.4      3.55    4       81.1       10.6
  268   4   0   3 38.148  76.296   0.401    3.52    2       22.1        0.4
  269   8   0  -2 38.283  76.566   0.402    3.5     2       51.1        2.1
  270   7   3   1 38.362  76.723   0.403    3.49    4       65.0        6.7
  271   2   8   3 38.364  76.728   0.403    3.49    4       15.1        0.4
  272   6  10  -1 38.467  76.933   0.404    3.47    4       29.3        1.3
  273   0  10   3 38.498  76.997   0.404    3.46    4       93.6       13.8
  274   4   2   3 38.573  77.147   0.405    3.45    4       99.7       15.6
  275   2  14  -1 38.588  77.176   0.405    3.45    4       52.2        4.3
  276   6   0   2 38.627  77.253   0.405    3.44    2      149.6       17.5
  277   7   7   0 38.643  77.285   0.405    3.44    4       35.7        2.0
  278   1  13  -2 38.687  77.375   0.406    3.44    4      122.6       23.4
  279   7   3  -3 38.7    77.399   0.406    3.43    4       22.5        0.8
  280   8   2  -2 38.708  77.416   0.406    3.43    4        8.6        0.1
  281   3   5  -4 38.755  77.511   0.406    3.43    4        9.7        0.1
  282   7   7  -2 38.811  77.623   0.407    3.42    4        0.1        0.0
  283   4   4  -4 38.835  77.67    0.407    3.41    4        4.7        0.0
  284   1   5  -4 38.853  77.706   0.407    3.41    4       82.9       10.6
  285   8   0   0 38.862  77.723   0.407    3.41    2      197.3       30.1
  286   8   4  -1 38.921  77.841   0.408    3.4     4       62.0        5.9
  287   5   1  -4 39.0    78.0     0.409    3.39    4       12.7        0.2
  288   0   4   4 39.031  78.061   0.409    3.39    4       80.1        9.9
  289   6   2   2 39.051  78.101   0.409    3.38    4       12.0        0.2
  290   5   7   2 39.105  78.21    0.409    3.37    4        3.6        0.0
  291   6   8   1 39.128  78.256   0.41     3.37    4       62.0        5.9
  292   4  12  -2 39.211  78.422   0.41     3.36    4       18.0        0.5
  293   5  11  -2 39.274  78.549   0.411    3.35    4      131.0       26.1
  294   8   2   0 39.285  78.569   0.411    3.35    4        8.7        0.1
  295   1   1   4 39.293  78.586   0.411    3.35    4       34.8        1.8
  296   6  10   0 39.356  78.713   0.412    3.34    4       61.9        5.8
  297   2  12   2 39.357  78.715   0.412    3.34    4       38.1        2.2
  298   3  13   1 39.394  78.789   0.412    3.33    4       16.0        0.4
  299   3  11   2 39.469  78.939   0.413    3.32    4       28.8        1.3
  300   2   6  -4 39.607  79.214   0.414    3.31    4       41.7        2.6
  301   4  12   1 39.642  79.285   0.414    3.3     4       70.7        7.5
  302   3   7   3 39.695  79.391   0.415    3.29    4       67.0        6.7
  303   4  10  -3 39.792  79.583   0.415    3.28    4        1.3        0.0
  304   4   4   3 39.842  79.683   0.416    3.27    4       11.2        0.2
  305   5   3  -4 39.844  79.688   0.416    3.27    4       65.1        6.3
  306   5   9  -3 39.905  79.811   0.416    3.27    4       56.9        4.8
  307   1  11  -3 39.961  79.923   0.417    3.26    4       92.2       12.6
  308   1  15   0 39.973  79.945   0.417    3.26    4       50.9        3.8
  309   8   4  -2 39.975  79.95    0.417    3.26    4      171.2       43.4
  310   7   5   1 40.053  80.106   0.418    3.25    4        9.4        0.1
  311   2  14   1 40.075  80.149   0.418    3.25    4       60.0        5.3
  312   3  13  -2 40.076  80.152   0.418    3.25    4       25.7        1.0
  313   1   3   4 40.136  80.271   0.418    3.24    4       15.4        0.4
  314   1  13   2 40.173  80.346   0.419    3.23    4       21.0        0.6
  315   6  10  -2 40.265  80.53    0.42     3.22    4      136.1       27.1
  316   6   4   2 40.315  80.629   0.42     3.22    4       31.1        1.4
  317   7   5  -3 40.387  80.774   0.421    3.21    4       71.3        7.4
  318   4  10   2 40.507  81.014   0.422    3.19    4       63.3        5.8
  319   8   4   0 40.547  81.094   0.422    3.19    4       41.5        2.5
  320   3  11  -3 40.603  81.207   0.422    3.18    4       23.2        0.8
  321   7   9  -1 40.758  81.516   0.424    3.16    4       51.9        3.9
  322   5  11   1 40.814  81.628   0.424    3.16    4       64.3        5.9
  323   1  15  -1 40.937  81.874   0.425    3.14    4       45.2        2.9
  324   4   6  -4 40.939  81.879   0.425    3.14    4       20.7        0.6
  325   6   8  -3 40.942  81.884   0.425    3.14    4       46.4        3.1
  326   8   6  -1 41.024  82.048   0.426    3.14    4        6.8        0.1
  327   0   6   4 41.132  82.265   0.427    3.12    4       32.4        1.5
  328   3   7  -4 41.279  82.558   0.428    3.11    4        1.0        0.0
  329   6   0  -4 41.35   82.699   0.429    3.1     2       21.5        0.3
  330   1   7  -4 41.375  82.751   0.429    3.1     4        6.7        0.1
  331   5   5  -4 41.52   83.04    0.43     3.08    4       87.1       10.6
  332   1  15   1 41.672  83.344   0.432    3.07    4       99.3       13.7
  333   2   0   4 41.735  83.47    0.432    3.06    2      254.4       45.0
  334   6   2  -4 41.767  83.534   0.432    3.06    4       11.7        0.2
  335   1   5   4 41.809  83.618   0.433    3.06    4       43.0        2.6
  336   2  14  -2 41.856  83.712   0.433    3.05    4       40.7        2.3
  337   0  14   2 41.904  83.808   0.434    3.05    4       75.5        7.9
  338   4   6   3 41.934  83.869   0.434    3.04    4       73.9        7.6
  339   7   9   0 42.002  84.004   0.434    3.04    4      154.0       32.7
  340   8   0  -3 42.007  84.013   0.434    3.04    2        4.0        0.0
  341   8   6  -2 42.066  84.132   0.435    3.03    4       51.0        3.6
  342   4  14  -1 42.137  84.274   0.435    3.03    4       33.9        1.6
  343   2  10   3 42.146  84.291   0.436    3.03    4       66.3        6.0
  344   5  13  -1 42.149  84.299   0.436    3.02    4        5.2        0.0
  345   2   2   4 42.152  84.303   0.436    3.02    4       15.3        0.3
  346   7   9  -2 42.168  84.335   0.436    3.02    4        8.3        0.1
  347   1  11   3 42.169  84.338   0.436    3.02    4       31.9        1.4
  348   4  14   0 42.279  84.557   0.437    3.01    4       66.5        6.0
  349   2  12  -3 42.329  84.658   0.437    3.01    4       71.8        7.0
  350   6   6   2 42.403  84.805   0.438    3.0     4       18.9        0.5
  351   8   2  -3 42.423  84.845   0.438    3.0     4       61.3        5.1
  352   5   9   2 42.456  84.912   0.438    3.0     4       93.1       11.8
  353   2   8  -4 42.535  85.069   0.439    2.99    4       11.6        0.2
  354   7   7   1 42.559  85.118   0.439    2.99    4      101.1       13.9
  355   5   1   3 42.579  85.158   0.439    2.99    4       11.0        0.2
  356   8   6   0 42.633  85.265   0.44     2.98    4       12.8        0.2
  357   5  13   0 42.657  85.314   0.44     2.98    4       99.0       13.3
  358   3  15   0 42.816  85.632   0.441    2.97    4       37.0        1.9
  359   0  16   0 42.853  85.707   0.441    2.97    2       16.4        0.2
  360   7   7  -3 42.89   85.779   0.442    2.96    4      141.7       27.0
  361   6  10   1 42.894  85.788   0.442    2.96    4       33.2        1.5
  362   6   4  -4 43.014  86.029   0.443    2.95    4      144.3       27.9
  363   3   9   3 43.037  86.074   0.443    2.95    4       29.4        1.2
  364   9   1  -1 43.039  86.078   0.443    2.95    4        0.7        0.0
  365   3  15  -1 43.04   86.08    0.443    2.95    4       51.6        3.6
  366   6  12  -1 43.077  86.154   0.443    2.95    4       64.9        5.6
  367   0  12   3 43.108  86.216   0.444    2.95    4       53.9        3.9
  368   8   0   1 43.139  86.278   0.444    2.94    2        0.4        0.0
  369   2   4   4 43.398  86.796   0.446    2.92    4       14.0        0.3
  370   5   3   3 43.409  86.818   0.446    2.92    4      103.3       14.2
  371   8   2   1 43.554  87.107   0.447    2.91    4       10.8        0.2
  372   8   4  -3 43.668  87.336   0.448    2.91    4        7.0        0.1
  373   9   1  -2 43.71   87.42    0.449    2.9     4       14.4        0.3
  374   4   8  -4 43.851  87.703   0.45     2.89    4       34.1        1.5
  375   9   3  -1 43.868  87.737   0.45     2.89    4       47.0        2.9
  376   8   8  -1 43.935  87.871   0.45     2.89    4       73.4        7.1
  377   6  12   0 43.948  87.896   0.45     2.89    4       49.3        3.2
  378   5   7  -4 44.013  88.026   0.451    2.88    4       39.4        2.0
  379   0   8   4 44.043  88.086   0.451    2.88    4       30.7        1.2
  380   5  11  -3 44.073  88.146   0.452    2.88    4       45.6        2.7
  381   7   1   2 44.093  88.186   0.452    2.88    4       68.7        6.2
  382   0  16   1 44.172  88.344   0.452    2.87    4      136.0       24.1
  383   2  16   0 44.265  88.53    0.453    2.87    4       20.4        0.5
  384   5  13  -2 44.282  88.563   0.453    2.87    4       27.6        1.0
  385   1   7   4 44.3    88.6     0.453    2.87    4       29.2        1.1
  386   4  12  -3 44.376  88.751   0.454    2.86    4       79.5        8.2
  387   3  13   2 44.473  88.946   0.455    2.86    4       97.1       12.2
  388   1  15  -2 44.536  89.072   0.455    2.85    4       13.6        0.2
  389   9   3  -2 44.539  89.078   0.455    2.85    4       80.1        8.3
  390   7   1  -4 44.587  89.174   0.456    2.85    4       31.9        1.3
  391   3   9  -4 44.602  89.204   0.456    2.85    4       40.1        2.1
  392   4  14  -2 44.634  89.268   0.456    2.85    4       61.5        4.9
  393   6  10  -3 44.683  89.366   0.456    2.84    4       43.0        2.4
  394   1   9  -4 44.698  89.396   0.457    2.84    4       73.4        7.0
  395   2  14   2 44.777  89.555   0.457    2.84    4       49.8        3.2
  396   8   4   1 44.797  89.593   0.457    2.84    4        6.4        0.1
  397   4   8   3 44.839  89.678   0.458    2.84    4       38.7        1.9
  398   6  12  -2 44.842  89.683   0.458    2.84    4      127.7       21.0
  399   2  16  -1 44.853  89.706   0.458    2.84    4       97.5       12.2
  400   7  11  -1 44.915  89.829   0.458    2.83    4       53.4        3.7
  401   7   3   2 44.921  89.843   0.458    2.83    4       73.1        6.9
  402   1  13  -3 44.957  89.914   0.459    2.83    4       37.6        1.8
  403   8   8  -2 44.97   89.94    0.459    2.83    4       49.6        3.2


  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   4.877   9.754  9.06045       10.6      1.4      1.4     5.6
    2   1   3   0   8.61   17.22   5.1451        30.5      4.1      4.1     5.6
    3   0   0   1   8.719  17.438  5.08146       21.8      2.9      2.9     5.6
    4   0   4   0   9.79   19.579  4.53022       30.7      4.1      4.1     5.6
    5   0   2   1  10.009  20.018  4.43202       35.4      4.7      4.7     5.6
    6   2   2   0  10.278  20.555  4.31729       13.2      1.8      1.8     5.6
    7   2   0  -1  10.761  21.523  4.12536       13.2      1.8      1.8     5.6
    8   1   1   1  11.135  22.27   3.98854      185.4     24.7     24.8     5.6
    9   1   3  -1  11.395  22.789  3.89887       10.5      1.4      1.4     5.6
   10   2   2  -1  11.839  23.678  3.7545       131.1     17.5     17.5     5.6
   11   1   5   0  13.094  26.188  3.40007       85.9     11.4     11.4     5.6
   12   1   3   1  13.149  26.299  3.38599      750.4    100.0    100.0     5.6
   13   2   4   0  13.376  26.751  3.32972      582.1     77.6     77.6     5.6
   14   3   1   0  13.833  27.667  3.22159      154.0     20.5     20.5     5.6
   15   3   1  -1  14.307  28.614  3.11706      127.9     17.0     17.0     5.6
   16   2   4  -1  14.628  29.255  3.05018       26.0      3.5      3.5     5.6
   17   0   6   0  14.776  29.553  3.02015       10.8      1.4      1.4     5.6
   18   2   2   1  15.062  30.124  2.96413      467.4     62.3     62.1     5.6
   19   1   5  -1  15.109  30.218  2.95514      118.5     15.8     15.7     5.6
   20   3   3   0  15.523  31.046  2.87819      145.7     19.4     19.3     5.6
   21   3   3  -1  15.951  31.902  2.80292      408.6     54.5     54.2     5.6
   22   1   5   1  16.5    33.0    2.71214      415.3     55.3     55.0     5.6
   23   1   1  -2  17.17   34.341  2.60921       41.3      5.5      5.5     5.7
   24   0   6   1  17.259  34.518  2.59621      358.9     47.8     47.5     5.7
   25   2   4   1  17.379  34.758  2.57888       17.5      2.3      2.3     5.7
   26   2   6   0  17.423  34.846  2.57255       28.7      3.8      3.8     5.7
   27   2   0  -2  17.565  35.131  2.55234      486.2     64.8     64.3     5.7
   28   0   0   2  17.648  35.297  2.54073       12.7      1.7      1.7     5.7
   29   1   7   0  17.922  35.843  2.5032        10.1      1.3      1.3     5.7
   30   4   0   0  18.284  36.567  2.45531       55.8      7.4      7.4     5.7
   31   2   6  -1  18.427  36.853  2.4369         7.6      1.0      1.0     5.7
   32   3   5   0  18.486  36.972  2.42936      140.9     18.8     18.6     5.7
   33   4   2  -1  18.737  37.474  2.39793      191.0     25.5     25.2     5.7
   34   3   5  -1  18.854  37.708  2.38358      100.7     13.4     13.3     5.7
   35   3   1  -2  19.454  38.908  2.3128        50.2      6.7      6.6     5.7
   36   1   7  -1  19.489  38.978  2.30879      229.3     30.6     30.2     5.7
   37   3   3   1  19.704  39.409  2.28456       40.9      5.4      5.4     5.7
   38   0   8   0  19.881  39.761  2.26511       15.2      2.0      2.0     5.7
   39   2   4  -2  20.267  40.534  2.2237       129.6     17.3     17.1     5.7
   40   0   4   2  20.34   40.681  2.21601       43.9      5.8      5.8     5.7
   41   4   4  -1  20.694  41.387  2.17982        8.2      1.1      1.1     5.7
   42   2   6   1  20.735  41.471  2.17562      350.1     46.7     46.0     5.7
   43   4   4   0  20.906  41.812  2.15865       12.8      1.7      1.7     5.7
   44   1   5  -2  21.178  42.357  2.13213       92.9     12.4     12.2     5.7
   45   0   8   1  21.859  43.717  2.06887       12.1      1.6      1.6     5.7
   46   4   0  -2  21.928  43.855  2.06268      109.2     14.6     14.3     5.7
   47   2   8   0  21.993  43.986  2.05684       13.8      1.8      1.8     5.7
   48   2   0   2  22.134  44.268  2.04441      153.1     20.4     20.1     5.7
   49   3   5   1  22.186  44.372  2.03986       35.2      4.7      4.6     5.7
   50   3   7   0  22.293  44.586  2.03057        7.5      1.0      1.0     5.7
   51   2   8  -1  22.827  45.654  1.98551       12.9      1.7      1.7     5.7
   52   1   9   0  22.987  45.975  1.97241       88.3     11.8     11.6     5.7
   53   3   5  -2  23.129  46.257  1.96102       74.4      9.9      9.7     5.7
   54   5   1   0  23.232  46.463  1.95281      127.5     17.0     16.7     5.7
   55   2   6  -2  23.274  46.548  1.94943        7.7      1.0      1.0     5.7
   56   4   6  -1  23.657  47.314  1.91966       94.2     12.6     12.3     5.7
   57   4   6   0  23.848  47.696  1.90516        7.7      1.0      1.0     5.7
   58   4   4  -2  24.225  48.45   1.87725       29.0      3.9      3.8     5.7
   59   1   9  -1  24.284  48.567  1.873         30.4      4.1      4.0     5.7
   60   5   3   0  24.353  48.707  1.86796        9.0      1.2      1.2     5.7
   61   2   8   1  24.8    49.601  1.83636       19.1      2.5      2.5     5.7
   62   0  10   0  25.156  50.311  1.81209       53.7      7.2      7.0     5.8
   63   1   9   1  25.242  50.483  1.80631       28.4      3.8      3.7     5.8
   64   3   7   1  25.546  51.091  1.78624       10.1      1.3      1.3     5.8
   65   3   1   2  25.64   51.28   1.78011       20.2      2.7      2.6     5.8
   66   1   1  -3  26.255  52.509  1.74129       13.5      1.8      1.8     5.8
   67   5   5   0  26.49   52.98   1.72692       24.3      3.2      3.2     5.8
   68   3   9  -1  26.965  53.931  1.6987        55.7      7.4      7.2     5.8
   69   2   8  -2  27.043  54.087  1.69416       19.4      2.6      2.5     5.8
   70   0   8   2  27.102  54.205  1.69075       14.9      2.0      1.9     5.8
   71   1   3  -3  27.285  54.569  1.68033       79.4     10.6     10.3     5.8
   72   4   6   1  27.407  54.815  1.67338      208.2     27.7     26.9     5.8
   73   0   2   3  27.557  55.115  1.66497      114.8     15.3     14.9     5.8
   74   6   0   0  28.072  56.144  1.63687       32.6      4.3      4.2     5.8
   75   2   4  -3  28.121  56.243  1.63423        9.7      1.3      1.2     5.8
   76   1  11   0  28.302  56.604  1.62466       51.5      6.9      6.7     5.8
   77   3   5   2  28.7    57.399  1.60403       13.9      1.9      1.8     5.8
   78   5   7  -1  28.896  57.792  1.59406       47.3      6.3      6.1     5.8
   79   4   2  -3  29.074  58.148  1.58514       11.0      1.5      1.4     5.8
   80   6   0  -2  29.135  58.27   1.58211      119.2     15.9     15.3     5.8
   81   1   5  -3  29.27   58.54   1.57545       87.2     11.6     11.2     5.8
   82   4   0   2  29.415  58.83   1.56837       65.1      8.7      8.4     5.8
   83   1   3   3  29.887  59.775  1.54583        8.0      1.1      1.0     5.8
   84   6   4   0  30.024  60.047  1.53946       15.2      2.0      1.9     5.8
   85   5   5   1  30.246  60.493  1.52919       39.1      5.2      5.0     5.8
   86   4   8  -2  30.336  60.672  1.52509       69.3      9.2      8.9     5.8
   87   1   9   2  30.471  60.941  1.51901       54.1      7.2      6.9     5.8
   88   2   6  -3  30.546  61.092  1.51561      206.5     27.5     26.5     5.8
   89   0  12   0  30.67   61.34   1.51007       85.1     11.3     10.9     5.8
   90   5   1  -3  31.112  62.224  1.49072        7.8      1.0      1.0     5.8
   91   4   4   2  31.314  62.629  1.48206       51.3      6.8      6.6     5.8
   92   6   6  -1  31.391  62.782  1.47881      189.2     25.2     24.2     5.9
   93   2  10  -2  31.421  62.841  1.47757       36.7      4.9      4.7     5.9
   94   0  10   2  31.474  62.949  1.4753        14.0      1.9      1.8     5.9
   95   3  11   0  31.564  63.128  1.47155       11.3      1.5      1.4     5.9
   96   4  10  -1  31.734  63.468  1.46448       13.6      1.8      1.7     5.9
   97   3  11  -1  31.814  63.627  1.46119       25.2      3.4      3.2     5.9
   98   4  10   0  31.891  63.783  1.45801       32.3      4.3      4.1     5.9
   99   5   3  -3  32.041  64.081  1.45194       36.1      4.8      4.6     5.9
  100   0  12   1  32.15   64.3    1.44751       13.3      1.8      1.7     5.9
  101   6   2   1  32.571  65.142  1.43084       21.7      2.9      2.8     5.9
  102   3   7  -3  32.801  65.602  1.4219        10.1      1.3      1.3     5.9
  103   2  12  -1  32.901  65.803  1.41806       16.4      2.2      2.1     5.9
  104   7   3  -1  32.969  65.937  1.41548       18.9      2.5      2.4     5.9
  105   4   6   2  33.601  67.203  1.39188        8.2      1.1      1.0     5.9
  106   5   5  -3  33.856  67.711  1.38266       20.4      2.7      2.6     5.9
  107   5   1   2  33.901  67.803  1.38101       64.9      8.6      8.2     5.9
  108   7   3   0  34.307  68.614  1.36665       12.8      1.7      1.6     5.9
  109   4  10  -2  34.459  68.918  1.36136       38.9      5.2      4.9     5.9
  110   6   2  -3  34.511  69.023  1.35955       15.4      2.1      2.0     5.9
  111   2  10   2  34.612  69.225  1.35607       27.6      3.7      3.5     5.9
  112   7   5  -1  34.759  69.518  1.35107       71.5      9.5      9.1     5.9
  113   5   3   2  34.79   69.581  1.35          28.9      3.8      3.7     5.9
  114   3  11  -2  34.924  69.849  1.34548       25.5      3.4      3.2     5.9
  115   5   9  -2  34.967  69.935  1.34403       24.6      3.3      3.1     5.9
  116   1  11   2  35.026  70.053  1.34206       27.4      3.6      3.5     5.9
  117   2   6   3  35.343  70.685  1.3316        48.5      6.5      6.1     5.9
  118   6   8   0  35.492  70.985  1.32671       28.9      3.8      3.6     5.9
  119   1   9  -3  35.683  71.366  1.32056       11.7      1.6      1.5     5.9
  120   1  13   1  35.72   71.441  1.31935       12.2      1.6      1.5     5.9
  121   6   6   1  36.129  72.258  1.30644        9.5      1.3      1.2     5.9
  122   3   1  -4  36.181  72.363  1.3048        33.9      4.5      4.3     5.9
  123   7   5  -2  36.239  72.477  1.30302       17.5      2.3      2.2     5.9
  124   1   1  -4  36.282  72.563  1.30169       34.7      4.6      4.4     6.0
  125   2  12  -2  36.348  72.695  1.29965      112.1     14.9     14.1     6.0
  126   0  12   2  36.398  72.796  1.2981        28.0      3.7      3.5     6.0
  127   5   5   2  36.539  73.078  1.29378       16.4      2.2      2.1     6.0
  128   4  12   0  36.787  73.575  1.28627       14.2      1.9      1.8     6.0
  129   3   3  -4  37.046  74.093  1.27856        7.7      1.0      1.0     6.0
  130   4   0  -4  37.127  74.254  1.27617       69.9      9.3      8.8     6.0
  131   0   0   4  37.326  74.651  1.27036       19.5      2.6      2.4     6.0
  132   8   2  -1  37.643  75.287  1.26122       10.4      1.4      1.3     6.0
  133   2  14   0  37.984  75.967  1.2516        23.5      3.1      2.9     6.0
  134   0  10   3  38.498  76.997  1.23741       13.8      1.8      1.7     6.0
  135   4   2   3  38.573  77.147  1.23538       19.9      2.6      2.5     6.0
  136   6   0   2  38.627  77.253  1.23394       19.5      2.6      2.4     6.0
  137   1  13  -2  38.687  77.375  1.23231       24.3      3.2      3.0     6.0
  138   8   0   0  38.862  77.723  1.22765       40.8      5.4      5.1     6.0
  139   0   4   4  39.031  78.061  1.22318       10.1      1.3      1.3     6.0
  140   5  11  -2  39.274  78.549  1.21681       28.1      3.7      3.5     6.0
  141   6  10   0  39.356  78.713  1.21468        8.0      1.1      1.0     6.0
  142   8   4  -2  39.975  79.95   1.19897       59.8      8.0      7.4     6.0
  143   6  10  -2  40.265  80.53   1.19179       27.1      3.6      3.4     6.1
  144   5   5  -4  41.52   83.04   1.16202       10.6      1.4      1.3     6.1
  145   1  15   1  41.672  83.344  1.15855       13.7      1.8      1.7     6.1
  146   2   0   4  41.735  83.47   1.15712       45.0      6.0      5.5     6.1
  147   0  14   2  41.904  83.808  1.15331       15.4      2.1      1.9     6.1
  148   7   9   0  42.002  84.004  1.15112       32.7      4.4      4.0     6.1
  149   2  10   3  42.146  84.291  1.14793        9.4      1.2      1.1     6.1
  150   5   9   2  42.456  84.912  1.14112       11.8      1.6      1.4     6.1
  151   7   7   1  42.559  85.118  1.13888       14.0      1.9      1.7     6.1
  152   5  13   0  42.657  85.314  1.13677       13.3      1.8      1.6     6.1
  153   7   7  -3  42.89   85.779  1.13179       28.5      3.8      3.5     6.1
  154   6   4  -4  43.014  86.029  1.12914       32.6      4.4      4.0     6.1
  155   5   3   3  43.409  86.818  1.12089       14.2      1.9      1.7     6.1
  156   8   8  -1  43.935  87.871  1.11016       10.3      1.4      1.2     6.2
  157   7   1   2  44.093  88.186  1.107          8.9      1.2      1.1     6.2
  158   0  16   1  44.172  88.344  1.10543       24.1      3.2      2.9     6.2
  159   4  12  -3  44.376  88.751  1.10141        8.2      1.1      1.0     6.2
  160   3  13   2  44.473  88.946  1.0995        12.2      1.6      1.5     6.2
  161   9   3  -2  44.539  89.078  1.09822        8.3      1.1      1.0     6.2
  162   1   9  -4  44.698  89.396  1.09513        9.3      1.2      1.1     6.2
  163   2  16  -1  44.853  89.706  1.09215       35.2      4.7      4.3     6.2
  164   7   3   2  44.921  89.843  1.09084       10.5      1.4      1.3     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)