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

                            ***

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

1

Na(2)Si(4)O(8)(OH)(2).4H(2)O


Monoclinic  P 2(1)/c  Z = 4

R =0.051          NR =834

9 .12 .1991

Ref.Str.:

         Annehed H., Falth L., Lincoln (1982)

         * Z. Kristallogr., 159, 203-210

                   Initial data from BDM-file 

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

             a =   7.3881   alpha =   90.0 
             b =  18.094    beta  =   90.64
             c =   9.5234   gamma =   90.0 

    Unit cell volume (cub. angs.) =  1273.01

    Molar volume ( cub.cm/mol.) =   191.7 

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

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

   1 0.2822  0.2143  0.1876   0.96   Si    = 1.00
   2 0.6997  0.2182  0.1748   1.08   Si    = 1.00
   3 0.7776  0.3388  0.3891   0.83   Si    = 1.00
   4 0.2001  0.3349  0.399    1.01   Si    = 1.00
   5 0.2421  0.2241  0.0224   1.74   O     = 1.00
   6 0.2476  0.2971  0.2507   1.41   O     = 1.00
   7 0.4931  0.1951  0.205    1.49   O     = 1.00
   8 0.7307  0.2232  0.0064   1.58   O     = 1.00
   9 0.7429  0.3001  0.2358   1.11   O     = 1.00
  10 0.9902  0.3597  0.3992   1.43   O     = 1.00
  11 0.1619  0.1517  0.2585   1.78   O     = 1.00
  12 0.824   0.1546  0.2444   1.58   O     = 1.00
  13 0.6662  0.4126  0.4075   1.3    O     = 1.00
  14 0.3175  0.4083  0.4202   1.4    O     = 1.00
  15 0.7506  0.4108  0.0029   1.93   H(2)O = 1.00
  16 0.245   0.408   0.0187   2.03   H(2)O = 1.00
  17 0.0296  0.0123  0.2336   2.46   H(2)O = 1.00
  18 0.4714  0.024   0.2529   2.18   H(2)O = 1.00
  19 0.5     0.5     0.0      2.73   Na    = 1.00
  20 0.0     0.5     0.0      2.71   Na    = 1.00
  21 0.7478  0.0324  0.1285   2.72   Na    = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.2822     0.2143     0.1876
     2       2     0.6997     0.2182     0.1748
     3       3     0.7776     0.3388     0.3891
     4       4     0.2001     0.3349     0.399 
     5       5     0.2421     0.2241     0.0224
     6       6     0.2476     0.2971     0.2507
     7       7     0.4931     0.1951     0.205 
     8       8     0.7307     0.2232     0.0064
     9       9     0.7429     0.3001     0.2358
    10      10     0.9902     0.3597     0.3992
    11      11     0.1619     0.1517     0.2585
    12      12     0.824      0.1546     0.2444
    13      13     0.6662     0.4126     0.4075
    14      14     0.3175     0.4083     0.4202
    15      15     0.7506     0.4108     0.0029
    16      16     0.245      0.408      0.0187
    17      17     0.0296     0.0123     0.2336
    18      18     0.4714     0.024      0.2529
    19      19     0.5        0.5        0.0   
    20      20     0.0        0.5        0.0   
    21      21     0.7478     0.0324     0.1285
    22       1     0.7178     0.7143     0.3124
    23       2     0.3003     0.7182     0.3252
    24       3     0.2224     0.8388     0.1109
    25       4     0.7999     0.8349     0.101 
    26       5     0.7579     0.7241     0.4776
    27       6     0.7524     0.7971     0.2493
    28       7     0.5069     0.6951     0.295 
    29       8     0.2693     0.7232     0.4936
    30       9     0.2571     0.8001     0.2642
    31      10     0.0098     0.8597     0.1008
    32      11     0.8381     0.6517     0.2415
    33      12     0.176      0.6546     0.2556
    34      13     0.3338     0.9126     0.0925
    35      14     0.6825     0.9083     0.0798
    36      15     0.2494     0.9108     0.4971
    37      16     0.755      0.908      0.4813
    38      17     0.9704     0.5123     0.2664
    39      18     0.5286     0.524      0.2471
    40      19     0.5        0.0        0.5   
    41      20     0.0        0.0        0.5   
    42      21     0.2522     0.5324     0.3715
    43       1     0.2822     0.2857     0.6876
    44       2     0.6997     0.2818     0.6748
    45       3     0.7776     0.1612     0.8891
    46       4     0.2001     0.1651     0.899 
    47       5     0.2421     0.2759     0.5224
    48       6     0.2476     0.2029     0.7507
    49       7     0.4931     0.3049     0.705 
    50       8     0.7307     0.2768     0.5064
    51       9     0.7429     0.1999     0.7358
    52      10     0.9902     0.1403     0.8992
    53      11     0.1619     0.3483     0.7585
    54      12     0.824      0.3454     0.7444
    55      13     0.6662     0.0874     0.9075
    56      14     0.3175     0.0917     0.9202
    57      15     0.7506     0.0892     0.5029
    58      16     0.245      0.092      0.5187
    59      17     0.0296     0.4877     0.7336
    60      18     0.4714     0.476      0.7529
    61      21     0.7478     0.4676     0.6285
    62       1     0.7178     0.7857     0.8124
    63       2     0.3003     0.7818     0.8252
    64       3     0.2224     0.6612     0.6109
    65       4     0.7999     0.6651     0.601 
    66       5     0.7579     0.7759     0.9776
    67       6     0.7524     0.7029     0.7493
    68       7     0.5069     0.8049     0.795 
    69       8     0.2693     0.7768     0.9936
    70       9     0.2571     0.6999     0.7642
    71      10     0.0098     0.6403     0.6008
    72      11     0.8381     0.8483     0.7415
    73      12     0.176      0.8454     0.7556
    74      13     0.3338     0.5874     0.5925
    75      14     0.6825     0.5917     0.5798
    76      15     0.2494     0.5892     0.9971
    77      16     0.755      0.592      0.9813
    78      17     0.9704     0.9877     0.7664
    79      18     0.5286     0.976      0.7471
    80      21     0.2522     0.9676     0.8715


X-ray density (g/cm cub.)   =      2.04

MU (1/cm) =      56.649    Mass attenuation coefficient (cm**2/g) =     27.821

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

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

    1    Si                  2.268        4
                                                 1.6075       5
                                                 1.6354       6
                                                 1.6032       7
                                                 1.5944      11
    2    Si                  2.268        4
                                                 1.6115       7
                                                 1.6251       8
                                                 1.6221       9
                                                 1.6104      12
    3    Si                  2.268        4
                                                 1.6368       9
                                                 1.6174      10
                                                 1.5794      13
                                                 1.6233       8
    4    Si                  2.268        4
                                                 1.6114       6
                                                 1.6144      10
                                                 1.5978      14
                                                 1.6152       5
    5    O                   3.432        8
                                                 2.5439       6
                                                 2.5819       7
                                                 2.6744      11
                                                 3.3277      16
                                                 2.6166       6
                                                 2.6628      10
                                                 3.4182      11
                                                 2.6474      14
    6    O                   3.432        7
                                                 2.5439       5
                                                 2.6274       7
                                                 2.6381      10
                                                 2.7072      11
                                                 2.6272      14
                                                 2.9845      16
                                                 2.6166       5
    7    O                   3.432        7
                                                 2.5819       5
                                                 2.6274       6
                                                 2.6441       8
                                                 2.6626       9
                                                 2.6252      11
                                                 2.5756      12
                                                 3.1337      18
    8    O                   3.432        8
                                                 2.6441       7
                                                 2.5909       9
                                                 2.668       12
                                                 3.3978      15
                                                 2.6138       9
                                                 2.648       10
                                                 3.41        12
                                                 2.6724      13
    9    O                   3.432        7
                                                 2.6626       7
                                                 2.5909       8
                                                 2.619       10
                                                 2.701       12
                                                 2.6757      13
                                                 2.9896      15
                                                 2.6138       8
   10    O                   3.432        7
                                                 2.6381       6
                                                 2.619        9
                                                 2.5801      13
                                                 2.5787      14
                                                 3.0398      17
                                                 2.6628       5
                                                 2.648        8
   11    O                   3.432        8
                                                 2.6744       5
                                                 2.7072       6
                                                 2.6252       7
                                                 2.4991      12
                                                 2.7145      17
                                                 3.2516      18
                                                 3.4182       5
                                                 2.7659      16
   12    O                   3.432        7
                                                 2.5756       7
                                                 2.668        8
                                                 2.701        9
                                                 2.4991      11
                                                 2.9918      17
                                                 3.41         8
                                                 2.7901      15
   13    O                   3.432        6
                                                 2.6757       9
                                                 2.5801      10
                                                 2.5816      14
                                                 3.1904      17
                                                 2.7194      18
                                                 2.6724       8
   14    O                   3.432        5
                                                 2.6272       6
                                                 2.5787      10
                                                 2.5816      13
                                                 3.0968      18
                                                 2.6474       5
   15    H(2)O               3.6          8
                                                 3.3978       8
                                                 2.9896       9
                                                 3.4952      17
                                                 3.5184      18
                                                 2.7901      12
                                                 3.5889      17
                                                 3.3475      18
                                                 3.2853      16
   16    H(2)O               3.6          6
                                                 3.3277       5
                                                 2.9845       6
                                                 2.7659      11
                                                 3.4478      17
                                                 3.2884      18
                                                 3.2853      15
   17    H(2)O               3.6          9
                                                 2.7145      11
                                                 2.9918      12
                                                 3.274       18
                                                 3.0398      10
                                                 3.1904      13
                                                 3.4898      14
                                                 3.4952      15
                                                 3.5889      15
                                                 3.4478      16
   18    H(2)O               3.6         10
                                                 3.1337       7
                                                 3.2516      11
                                                 3.5188      12
                                                 3.274       17
                                                 2.7194      13
                                                 3.0968      14
                                                 3.5184      15
                                                 3.571       14
                                                 3.3475      15
                                                 3.2884      16
   19    Na                  2.976        6
                                                 2.4561      15
                                                 2.5218      16
                                                 2.4         18
                                                 2.4         18
                                                 2.4561      15
                                                 2.5218      16
   20    Na                  2.976        6
                                                 2.4499      15
                                                 2.4641      16
                                                 2.5586      17
                                                 2.5586      17
                                                 2.4499      15
                                                 2.4641      16
   21    Na                  2.976        5
                                                 2.5318      12
                                                 2.3285      17
                                                 2.3771      18
                                                 2.342       14
                                                 2.399       13

  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  4.884   9.768   0.055  272.91    2      115.8      451.7
    2   0   1   1  5.245  10.489   0.059  236.4     4       63.1      232.2
    3   1   0   0  5.985  11.97    0.068  181.0     2        2.5        0.1
    4   1   1   0  6.466  12.933   0.073  154.72    4        6.1        1.4
    5   0   2   1  6.744  13.489   0.076  142.05    4        0.2        0.0
    6   1   2   0  7.736  15.472   0.087  107.42    4       11.2        3.4
    7   1   1  -1  7.931  15.862   0.09   102.1     4       10.7        2.9
    8   1   1   1  8.01   16.019   0.09   100.07    4       15.0        5.5
    9   0   3   1  8.695  17.39    0.098   84.58    4      166.4      577.8
   10   1   2  -1  9.001  18.001   0.102   78.78    4       10.5        2.2
   11   1   2   1  9.07   18.14    0.102   77.55    4       32.3       20.0
   12   0   0   2  9.31   18.62    0.105   73.49    2       49.7       22.4
   13   1   3   0  9.49   18.979   0.107   70.65    4       22.3        8.7
   14   0   1   2  9.63   19.26    0.109   68.55    4       15.8        4.2
   15   0   4   0  9.804  19.609   0.111   66.05    2       49.7       20.1
   16   0   2   2 10.534  21.067   0.119   56.94    4       90.9      116.1
   17   1   3  -1 10.552  21.104   0.119   56.73    4       39.1       21.4
   18   1   3   1 10.612  21.224   0.12    56.07    4        2.9        0.1
   19   0   4   1 10.866  21.733   0.122   53.37    4        4.8        0.3
   20   1   0  -2 11.039  22.079   0.124   51.65    2       17.6        2.0
   21   1   0   2 11.154  22.307   0.126   50.55    2       46.1       13.3
   22   1   1  -2 11.312  22.625   0.127   49.08    4       56.3       38.3
   23   1   1   2 11.424  22.848   0.129   48.09    4       58.8       41.0
   24   1   4   0 11.518  23.035   0.13    47.28    4       61.6       44.3
   25   0   3   2 11.895  23.789   0.134   44.2     4      109.4      130.5
   26   2   0   0 12.036  24.073   0.135   43.11    2      269.4      386.0
   27   1   2  -2 12.097  24.193   0.136   42.67    4       53.5       30.1
   28   1   2   2 12.201  24.403   0.137   41.9     4        4.5        0.2
   29   2   1   0 12.288  24.577   0.138   41.28    4       28.5        8.3
   30   1   4  -1 12.415  24.83    0.14    40.4     4       59.6       35.4
   31   1   4   1 12.467  24.933   0.14    40.05    4       23.8        5.6
   32   2   2   0 13.017  26.034   0.146   36.56    4      192.0      332.8
   33   2   1  -1 13.112  26.224   0.147   36.01    4       67.4       40.3
   34   0   5   1 13.162  26.324   0.148   35.72    4       81.4       58.4
   35   2   1   1 13.209  26.419   0.148   35.45    4       62.6       34.3
   36   1   3  -2 13.307  26.614   0.149   34.9     4       24.6        5.2
   37   1   3   2 13.403  26.806   0.15    34.37    4       34.6       10.1
   38   0   4   2 13.584  27.169   0.152   33.41    4       56.1       26.0
   39   1   5   0 13.711  27.422   0.154   32.76    4       24.0        4.6
   40   2   2  -1 13.8    27.601   0.155   32.31    4       26.3        5.5
   41   2   2   1 13.893  27.786   0.156   31.85    4       41.6       13.6
   42   2   3   0 14.154  28.308   0.159   30.62    4       12.8        1.2
   43   0   1   3 14.263  28.526   0.16    30.12    4      141.9      149.7
   44   1   5  -1 14.481  28.963   0.162   29.16    4        5.9        0.3
   45   1   5   1 14.526  29.052   0.163   28.97    4        6.3        0.3
   46   0   6   0 14.799  29.598   0.166   27.84    2       98.2       33.1
   47   1   4  -2 14.848  29.695   0.166   27.64    4        5.8        0.2
   48   2   3  -1 14.882  29.764   0.167   27.51    4       22.6        3.5
   49   0   2   3 14.902  29.804   0.167   27.43    4      174.6      206.4
   50   1   4   2 14.934  29.869   0.167   27.3     4       52.2       18.4
   51   2   3   1 14.969  29.938   0.168   27.17    4       14.9        1.5
   52   2   0  -2 15.218  30.436   0.17    26.22    2       26.8        2.3
   53   2   0   2 15.388  30.776   0.172   25.6     2       22.2        1.6
   54   2   1  -2 15.422  30.844   0.173   25.48    4       13.1        1.1
   55   1   1  -3 15.454  30.908   0.173   25.37    4       41.6       10.8
   56   0   5   2 15.507  31.014   0.174   25.18    4      145.5      131.6
   57   0   6   1 15.541  31.082   0.174   25.06    4      100.5       62.5
   58   1   1   3 15.58   31.159   0.174   24.93    4       30.1        5.6
   59   2   1   2 15.59   31.179   0.174   24.9     4        0.6        0.0
   60   2   4   0 15.618  31.236   0.175   24.8     4       39.1        9.4
   61   0   3   3 15.916  31.831   0.178   23.81    4       21.8        2.8
   62   1   6   0 16.015  32.03    0.179   23.49    4       72.5       30.5
   63   2   2  -2 16.019  32.038   0.179   23.48    4       57.0       18.8
   64   1   2  -3 16.05   32.1     0.179   23.38    4       45.1       11.8
   65   1   2   3 16.172  32.343   0.181   23.0     4        3.7        0.1
   66   2   2   2 16.181  32.362   0.181   22.97    4       52.4       15.6
   67   2   4  -1 16.287  32.573   0.182   22.65    4        5.2        0.2
   68   2   4   1 16.367  32.733   0.183   22.41    4       26.1        3.8
   69   1   5  -2 16.637  33.274   0.186   21.63    4       51.0       13.9
   70   1   6  -1 16.689  33.378   0.186   21.49    4       28.9        4.4
   71   1   5   2 16.716  33.431   0.187   21.41    4       28.3        4.2
   72   1   6   1 16.728  33.456   0.187   21.38    4       58.6       18.1
   73   2   3  -2 16.973  33.945   0.189   20.71    4       41.5        8.8
   74   1   3  -3 17.002  34.004   0.19    20.64    4       36.8        6.9
   75   1   3   3 17.118  34.235   0.191   20.33    4        0.4        0.0
   76   2   3   2 17.127  34.253   0.191   20.31    4       34.4        5.9
   77   0   4   3 17.244  34.489   0.192   20.01    4       32.3        5.1
   78   2   5   0 17.336  34.673   0.193   19.78    4        5.7        0.2
   79   0   6   2 17.599  35.197   0.196   19.14    4      105.4       52.5
   80   2   5  -1 17.948  35.896   0.2     18.33    4      133.0       80.1
   81   0   7   1 17.986  35.971   0.2     18.25    4       42.0        8.0
   82   2   5   1 18.022  36.043   0.201   18.17    4      131.3       77.3
   83   3   0   0 18.228  36.456   0.203   17.72    2        7.7        0.1
   84   2   4  -2 18.233  36.467   0.203   17.71    4       38.4        6.4
   85   1   4  -3 18.261  36.523   0.203   17.65    4       15.2        1.0
   86   1   4   3 18.37   36.74    0.205   17.42    4       60.5       15.8
   87   2   4   2 18.378  36.757   0.205   17.4     4       11.8        0.6
   88   3   1   0 18.402  36.804   0.205   17.36    4        7.9        0.3
   89   1   7   0 18.404  36.808   0.205   17.35    4       25.4        2.8
   90   1   6  -2 18.616  37.233   0.207   16.92    4       14.1        0.8
   91   1   6   2 18.688  37.375   0.208   16.78    4       12.6        0.7
   92   2   1  -3 18.725  37.449   0.208   16.7     4       27.0        3.0
   93   0   5   3 18.832  37.663   0.21    16.49    4       60.2       14.8
   94   0   0   4 18.878  37.756   0.21    16.41    2       85.6       14.8
   95   3   2   0 18.916  37.832   0.21    16.33    4       14.0        0.8
   96   2   1   3 18.937  37.873   0.211   16.29    4       35.2        5.0
   97   3   1  -1 18.966  37.933   0.211   16.24    4       71.0       20.2
   98   1   7  -1 19.003  38.006   0.211   16.17    4       54.2       11.7
   99   1   7   1 19.038  38.076   0.212   16.1     4       48.8        9.4
  100   0   1   4 19.047  38.094   0.212   16.09    4      131.2       68.4
  101   3   1   1 19.071  38.143   0.212   16.04    4       15.3        0.9
  102   2   2  -3 19.231  38.462   0.214   15.75    4       38.1        5.6
  103   2   6   0 19.253  38.506   0.214   15.71    4       75.3       22.0
  104   2   2   3 19.438  38.877   0.216   15.38    4       38.0        5.5
  105   3   2  -1 19.467  38.935   0.216   15.33    4       42.7        6.9
  106   0   2   4 19.546  39.092   0.217   15.19    4        0.8        0.0
  107   3   2   1 19.57   39.141   0.217   15.15    4       32.0        3.8
  108   3   3   0 19.747  39.494   0.219   14.85    4       26.1        2.5
  109   2   5  -2 19.752  39.504   0.219   14.84    4       90.9       30.3
  110   1   5  -3 19.778  39.556   0.22    14.8     4        6.4        0.2
  111   1   0  -4 19.805  39.611   0.22    14.75    2        5.3        0.1
  112   2   6  -1 19.814  39.627   0.22    14.74    4        4.6        0.1
  113   0   7   2 19.821  39.641   0.22    14.73    4        0.3        0.0
  114   1   5   3 19.88   39.759   0.221   14.63    4       36.8        4.9
  115   2   6   1 19.881  39.762   0.221   14.63    4       25.8        2.4
  116   2   5   2 19.887  39.775   0.221   14.62    4       83.6       25.2
  117   0   8   0 19.911  39.823   0.221   14.58    2       18.1        0.6
  118   1   0   4 19.94   39.881   0.221   14.53    2       25.4        1.2
  119   1   1  -4 19.968  39.935   0.222   14.49    4        6.0        0.1
  120   2   3  -3 20.051  40.102   0.223   14.35    4       39.9        5.6
  121   1   1   4 20.102  40.204   0.223   14.27    4       47.4        7.9
  122   2   3   3 20.251  40.503   0.225   14.04    4       45.2        7.1
  123   3   3  -1 20.279  40.559   0.225   14.0     4       53.1        9.8
  124   0   3   4 20.356  40.711   0.226   13.88    4       26.3        2.4
  125   3   3   1 20.379  40.758   0.226   13.84    4       28.8        2.8
  126   1   2  -4 20.448  40.896   0.227   13.74    4        7.5        0.2
  127   0   8   1 20.49   40.98    0.227   13.68    4        8.7        0.3
  128   3   0  -2 20.521  41.042   0.228   13.63    2       56.0        5.3
  129   1   2   4 20.58   41.16    0.228   13.55    4       17.7        1.0
  130   0   6   3 20.629  41.258   0.229   13.47    4       63.8       13.5
  131   3   1  -2 20.678  41.357   0.229   13.4     4       38.9        5.0
  132   3   0   2 20.717  41.435   0.23    13.35    2       13.9        0.3
  133   1   7  -2 20.745  41.491   0.23    13.3     4       23.1        1.7
  134   1   7   2 20.81   41.621   0.231   13.21    4       29.7        2.9
  135   3   4   0 20.864  41.727   0.231   13.14    4       50.3        8.2
  136   1   8   0 20.865  41.731   0.231   13.13    4       42.0        5.7
  137   3   1   2 20.874  41.748   0.231   13.12    4       32.5        3.4
  138   3   2  -2 21.146  42.291   0.234   12.75    4       45.6        6.5
  139   2   4  -3 21.155  42.309   0.234   12.74    4        9.4        0.3
  140   1   3  -4 21.229  42.458   0.235   12.64    4       31.5        3.1
  141   2   7   0 21.328  42.657   0.236   12.5     4        0.3        0.0
  142   3   2   2 21.337  42.675   0.236   12.49    4       20.9        1.3
  143   2   4   3 21.346  42.693   0.236   12.48    4       24.7        1.9
  144   1   3   4 21.357  42.713   0.236   12.47    4        1.2        0.0
  145   3   4  -1 21.373  42.746   0.237   12.45    4       36.0        4.0
  146   1   8  -1 21.407  42.813   0.237   12.4     4       30.1        2.8
  147   1   8   1 21.438  42.877   0.237   12.36    4       15.2        0.7
  148   0   4   4 21.446  42.892   0.237   12.35    4       85.0       22.0
  149   3   4   1 21.468  42.937   0.238   12.32    4       18.6        1.0
  150   2   6  -2 21.485  42.97    0.238   12.3     4       54.0        8.9
  151   1   6  -3 21.509  43.019   0.238   12.27    4       35.4        3.8
  152   1   6   3 21.604  43.208   0.239   12.15    4       48.7        7.1
  153   2   6   2 21.612  43.223   0.239   12.14    4       71.7       15.4
  154   2   7  -1 21.845  43.69    0.242   11.85    4        2.0        0.0
  155   3   3  -2 21.906  43.812   0.242   11.78    4       44.9        5.9
  156   2   7   1 21.907  43.815   0.242   11.77    4        6.5        0.1
  157   3   3   2 22.093  44.185   0.244   11.55    4       76.0       16.5
  158   0   8   2 22.15   44.301   0.245   11.49    4       47.1        6.3
  159   3   5   0 22.232  44.463   0.246   11.39    4       15.8        0.7
  160   1   4  -4 22.285  44.569   0.246   11.33    4        8.3        0.2
  161   1   4   4 22.408  44.815   0.247   11.19    4        1.6        0.0
  162   2   5  -3 22.508  45.016   0.248   11.08    4       31.1        2.6
  163   2   0  -4 22.518  45.035   0.249   11.07    2       26.0        0.9
  164   0   7   3 22.6    45.201   0.249   10.98    4        7.4        0.1
  165   2   1  -4 22.664  45.328   0.25    10.91    4       59.6        9.6
  166   2   5   3 22.691  45.382   0.25    10.88    4       35.4        3.4
  167   3   5  -1 22.716  45.433   0.251   10.85    4       20.8        1.2
  168   2   0   4 22.761  45.521   0.251   10.8     2       37.4        1.9
  169   0   5   4 22.786  45.572   0.251   10.77    4        4.8        0.1
  170   3   5   1 22.807  45.614   0.252   10.75    4       42.8        4.9
  171   2   1   4 22.906  45.812   0.253   10.65    4       50.1        6.6
  172   3   4  -2 22.937  45.874   0.253   10.62    4       28.6        2.1
  173   1   8  -2 22.999  45.997   0.254   10.55    4       18.8        0.9
  174   0   9   1 23.053  46.106   0.254   10.49    4       25.0        1.6
  175   1   8   2 23.059  46.117   0.254   10.49    4       24.5        1.5
  176   2   2  -4 23.099  46.198   0.255   10.45    4       99.8       25.7
  177   3   4   2 23.117  46.234   0.255   10.43    4       69.6       12.5
  178   3   1  -3 23.331  46.661   0.257   10.21    4        0.7        0.0
  179   2   2   4 23.337  46.674   0.257   10.21    4       94.5       22.5
  180   1   9   0 23.395  46.791   0.258   10.15    4       31.1        2.4
  181   2   7  -2 23.398  46.797   0.258   10.15    4       17.3        0.8
  182   1   7  -3 23.421  46.842   0.258   10.12    4       35.6        3.2
  183   1   7   3 23.51   47.019   0.259   10.04    4       39.3        3.8
  184   2   7   2 23.517  47.033   0.259   10.03    4       31.2        2.4
  185   2   8   0 23.537  47.074   0.259   10.01    4       93.0       21.4
  186   1   5  -4 23.587  47.174   0.26     9.96    4        2.0        0.0
  187   3   1   3 23.597  47.193   0.26     9.95    4        9.5        0.2
  188   1   5   4 23.704  47.409   0.261    9.85    4       47.1        5.4
  189   3   2  -3 23.756  47.512   0.261    9.8     4       36.5        3.2
  190   2   3  -4 23.81   47.62    0.262    9.75    4       21.9        1.2
  191   3   6   0 23.818  47.637   0.262    9.75    4      113.3       30.9
  192   1   9  -1 23.891  47.782   0.263    9.68    4       20.2        1.0
  193   1   9   1 23.92   47.84    0.263    9.65    4       30.0        2.1
  194   0   1   5 23.996  47.992   0.264    9.58    4      110.1       28.7
  195   2   8  -1 24.016  48.031   0.264    9.57    4       34.1        2.8
  196   3   2   3 24.018  48.037   0.264    9.56    4       17.1        0.7
  197   2   3   4 24.043  48.085   0.264    9.54    4       29.2        2.0
  198   2   8   1 24.074  48.147   0.265    9.51    4       24.6        1.4
  199   2   6  -3 24.081  48.162   0.265    9.51    4       71.7       12.1
  200   3   5  -2 24.212  48.424   0.266    9.39    4       12.9        0.4
  201   2   6   3 24.254  48.508   0.267    9.35    4       79.2       14.5
  202   3   6  -1 24.279  48.557   0.267    9.33    4       32.9        2.5
  203   0   6   4 24.345  48.689   0.268    9.27    4       10.7        0.3
  204   3   6   1 24.365  48.73    0.268    9.26    4       55.5        7.0
  205   3   5   2 24.385  48.769   0.268    9.24    4       11.8        0.3
  206   0   2   5 24.413  48.825   0.268    9.22    4        8.3        0.2
  207   3   3  -3 24.452  48.905   0.269    9.18    4        0.4        0.0
  208   0   9   2 24.576  49.151   0.27     9.08    4        7.5        0.1
  209   4   0   0 24.649  49.299   0.271    9.02    2      241.6       65.0
  210   3   3   3 24.709  49.418   0.271    8.97    4        7.3        0.1
  211   0   8   3 24.72   49.439   0.271    8.96    4       74.6       12.3
  212   1   1  -5 24.753  49.506   0.272    8.93    4        2.7        0.0
  213   2   4  -4 24.779  49.558   0.272    8.91    4       37.5        3.1
  214   4   1   0 24.786  49.572   0.272    8.9     4       34.1        2.6
  215   1   1   5 24.894  49.789   0.273    8.81    4       17.4        0.7
  216   2   4   4 25.005  50.01    0.274    8.73    4       54.6        6.4
  217   0   3   5 25.095  50.191   0.275    8.65    4        2.5        0.0
  218   1   6  -4 25.108  50.215   0.275    8.65    4       27.6        1.6
  219   1   2  -5 25.16   50.32    0.276    8.6     4        8.3        0.1
  220   4   2   0 25.193  50.386   0.276    8.58    4       33.9        2.4
  221   0  10   0 25.196  50.391   0.276    8.58    2       71.3        5.4
  222   4   1  -1 25.219  50.438   0.277    8.56    4        4.6        0.0
  223   1   6   4 25.22   50.439   0.277    8.56    4        6.8        0.1
  224   1   2   5 25.3    50.6     0.277    8.5     4       34.8        2.5
  225   4   1   1 25.331  50.662   0.278    8.47    4       12.5        0.3
  226   1   9  -2 25.361  50.723   0.278    8.45    4       15.9        0.5
  227   3   4  -3 25.403  50.807   0.278    8.42    4       50.0        5.2
  228   1   9   2 25.417  50.834   0.279    8.41    4       15.4        0.5
  229   2   8  -2 25.467  50.934   0.279    8.37    4       12.3        0.3
  230   1   8  -3 25.488  50.976   0.279    8.35    4       80.8       13.5
  231   1   8   3 25.571  51.143   0.28     8.29    4       27.8        1.6
  232   2   8   2 25.578  51.156   0.28     8.29    4       11.9        0.3
  233   3   7   0 25.596  51.192   0.28     8.27    4       46.7        4.5
  234   4   2  -1 25.621  51.242   0.281    8.26    4       11.6        0.3
  235   3   4   3 25.653  51.306   0.281    8.23    4       87.0       15.4
  236   0  10   1 25.679  51.358   0.281    8.21    4      113.5       26.1
  237   3   6  -2 25.705  51.41    0.282    8.19    4       18.0        0.7
  238   4   2   1 25.731  51.463   0.282    8.18    4       32.7        2.2
  239   1   3  -5 25.828  51.656   0.283    8.11    4       83.0       13.8
  240   2   7  -3 25.845  51.69    0.283    8.09    4       55.7        6.2
  241   4   3   0 25.86   51.721   0.283    8.08    4       16.3        0.5
  242   2   9   0 25.862  51.725   0.283    8.08    4        4.8        0.0
  243   3   6   2 25.87   51.74    0.283    8.08    4       13.2        0.3
  244   1   3   5 25.966  51.931   0.284    8.01    4       32.1        2.0
  245   2   5  -4 25.986  51.971   0.284    7.99    4       12.3        0.3
  246   1  10   0 25.995  51.99    0.285    7.99    4       61.9        7.6
  247   2   7   3 26.01   52.02    0.285    7.98    4       41.8        3.4
  248   0   4   5 26.029  52.058   0.285    7.96    4        3.3        0.0
  249   3   7  -1 26.033  52.066   0.285    7.96    4       27.7        1.5
  250   0   7   4 26.096  52.192   0.286    7.92    4       26.4        1.4
  251   3   7   1 26.115  52.23    0.286    7.9     4       60.5        7.1
  252   2   5   4 26.204  52.408   0.287    7.84    4        6.7        0.1
  253   4   3  -1 26.281  52.561   0.287    7.79    4       73.2       10.3
  254   2   9  -1 26.31   52.619   0.288    7.77    4        6.4        0.1
  255   2   9   1 26.364  52.728   0.288    7.74    4       33.7        2.2
  256   4   3   1 26.389  52.778   0.289    7.72    4       58.0        6.4
  257   1  10  -1 26.454  52.908   0.289    7.68    4        3.7        0.0
  258   4   0  -2 26.465  52.93    0.289    7.67    2       16.4        0.3
  259   1  10   1 26.481  52.963   0.289    7.66    4       40.2        3.0
  260   3   0  -4 26.584  53.168   0.29     7.59    2       42.6        1.7
  261   3   5  -3 26.589  53.179   0.291    7.59    4       30.0        1.7
  262   4   1  -2 26.595  53.19    0.291    7.58    4       18.9        0.7
  263   4   0   2 26.681  53.362   0.291    7.53    2       10.3        0.1
  264   3   1  -4 26.714  53.427   0.292    7.51    4       24.2        1.1
  265   1   4  -5 26.744  53.487   0.292    7.49    4       23.9        1.1
  266   4   4   0 26.775  53.55    0.292    7.47    4       74.9       10.3
  267   4   1   2 26.81   53.62    0.293    7.45    4        1.0        0.0
  268   1   7  -4 26.822  53.645   0.293    7.44    4       29.0        1.5
  269   3   5   3 26.831  53.663   0.293    7.43    4        6.5        0.1
  270   1   4   5 26.878  53.755   0.293    7.4     4        8.1        0.1
  271   3   0   4 26.907  53.813   0.294    7.38    2       26.9        0.7
  272   1   7   4 26.93   53.859   0.294    7.37    4       12.9        0.3
  273   0   9   3 26.97   53.94    0.294    7.35    4       34.6        2.2
  274   4   2  -2 26.982  53.964   0.295    7.34    4       36.1        2.4
  275   3   1   4 27.035  54.07    0.295    7.31    4       42.8        3.3
  276   2   1  -5 27.062  54.124   0.295    7.29    4       41.5        3.1
  277   0  10   2 27.091  54.183   0.296    7.27    4        1.0        0.0
  278   3   2  -4 27.1    54.199   0.296    7.27    4        8.1        0.1
  279   4   4  -1 27.185  54.37    0.297    7.21    4       23.5        1.0
  280   4   2   2 27.195  54.39    0.297    7.21    4       25.5        1.2
  281   0   5   5 27.196  54.392   0.297    7.21    4       76.3       10.4
  282   4   4   1 27.291  54.583   0.298    7.15    4       61.9        6.8
  283   2   1   5 27.328  54.655   0.298    7.13    4       43.7        3.4
  284   3   7  -2 27.393  54.786   0.299    7.09    4       55.7        5.4
  285   2   6  -4 27.409  54.817   0.299    7.08    4       97.8       16.7
  286   3   2   4 27.418  54.836   0.299    7.08    4        3.8        0.0
  287   2   2  -5 27.445  54.889   0.299    7.06    4       42.6        3.2
  288   3   8   0 27.543  55.086   0.3      7.0     4       27.7        1.3
  289   3   7   2 27.551  55.103   0.3      7.0     4       33.0        1.9
  290   4   3  -2 27.619  55.238   0.301    6.96    4       17.9        0.5
  291   2   6   4 27.619  55.239   0.301    6.96    4      100.6       17.4
  292   2   9  -2 27.674  55.347   0.301    6.93    4       23.4        0.9
  293   1   9  -3 27.694  55.387   0.302    6.92    4       12.5        0.3
  294   2   2   5 27.708  55.416   0.302    6.91    4       16.3        0.5
  295   3   3  -4 27.735  55.47    0.302    6.89    4        0.3        0.0
  296   1   9   3 27.772  55.545   0.302    6.87    4       19.7        0.7
  297   2   9   2 27.778  55.557   0.303    6.87    4       27.2        1.3
  298   2   8  -3 27.78   55.56    0.303    6.87    4        4.2        0.0
  299   1  10  -2 27.826  55.653   0.303    6.84    4       18.5        0.6
  300   4   3   2 27.829  55.658   0.303    6.84    4        5.8        0.1
  301   1  10   2 27.879  55.757   0.304    6.81    4        4.9        0.0
  302   1   5  -5 27.89   55.779   0.304    6.81    4        1.2        0.0
  303   4   5   0 27.92   55.84    0.304    6.79    4        9.0        0.1
  304   2   8   3 27.937  55.873   0.304    6.78    4       18.4        0.6
  305   3   8  -1 27.959  55.918   0.304    6.77    4       58.7        5.8
  306   3   6  -3 27.991  55.982   0.305    6.75    4        9.2        0.1
  307   0   8   4 28.019  56.037   0.305    6.74    4       30.2        1.5
  308   1   5   5 28.02   56.04    0.305    6.73    4       60.5        6.1
  309   3   8   1 28.037  56.074   0.305    6.73    4        5.2        0.0
  310   3   3   4 28.048  56.096   0.305    6.72    4        1.1        0.0
  311   2   3  -5 28.075  56.149   0.305    6.7     4       24.0        1.0
  312   3   6   3 28.225  56.45    0.307    6.62    4        1.6        0.0
  313   2  10   0 28.297  56.594   0.308    6.59    4        0.8        0.0
  314   4   5  -1 28.319  56.638   0.308    6.57    4       61.4        6.1
  315   2   3   5 28.334  56.668   0.308    6.57    4       36.2        2.1
  316   0  11   1 28.373  56.747   0.308    6.55    4       72.5        8.5
  317   4   5   1 28.422  56.845   0.309    6.52    4       55.2        4.9
  318   4   4  -2 28.495  56.989   0.31     6.48    4       45.6        3.3
  319   0   6   5 28.577  57.155   0.311    6.44    4       56.0        5.0
  320   3   4  -4 28.608  57.216   0.311    6.43    4       11.5        0.2
  321   1  11   0 28.669  57.338   0.311    6.39    4        5.7        0.1
  322   4   4   2 28.7    57.4     0.312    6.38    4       20.2        0.6
  323   1   8  -4 28.712  57.424   0.312    6.37    4       13.2        0.3
  324   2  10  -1 28.718  57.436   0.312    6.37    4       68.5        7.4
  325   2  10   1 28.769  57.539   0.312    6.34    4       68.8        7.4
  326   1   8   4 28.814  57.629   0.313    6.32    4        0.5        0.0
  327   4   1  -3 28.82   57.64    0.313    6.32    4       72.0        8.1
  328   3   4   4 28.915  57.83    0.314    6.27    4       22.2        0.8
  329   2   4  -5 28.941  57.882   0.314    6.26    4        4.1        0.0
  330   2   7  -4 29.029  58.058   0.315    6.22    4       16.0        0.4
  331   0   0   6 29.034  58.068   0.315    6.21    2       31.3        0.8
  332   1  11  -1 29.099  58.199   0.316    6.18    4        4.8        0.0
  333   1  11   1 29.125  58.25    0.316    6.17    4       22.1        0.7
  334   4   1   3 29.126  58.251   0.316    6.17    4       76.1        8.8
  335   0   1   6 29.156  58.312   0.316    6.16    4      108.5       17.9
  336   4   2  -3 29.187  58.374   0.317    6.14    4       16.6        0.4
  337   2   4   5 29.195  58.391   0.317    6.14    4       14.8        0.3
  338   2   7   4 29.232  58.464   0.317    6.12    4        1.8        0.0
  339   1   6  -5 29.25   58.499   0.317    6.11    4       29.9        1.3
  340   3   8  -2 29.258  58.516   0.317    6.11    4        1.6        0.0
  341   4   6   0 29.279  58.558   0.317    6.1     4       46.9        3.3
  342   0  10   3 29.342  58.683   0.318    6.07    4       47.2        3.3
  343   1   6   5 29.376  58.752   0.318    6.05    4       18.0        0.5
  344   3   8   2 29.41   58.819   0.319    6.04    4        2.0        0.0
  345   4   2   3 29.49   58.981   0.32     6.0     4       13.7        0.3
  346   0   2   6 29.521  59.042   0.32     5.99    4       17.5        0.5
  347   3   7  -3 29.59   59.181   0.321    5.95    4       11.5        0.2
  348   4   5  -2 29.596  59.191   0.321    5.95    4       68.3        6.8
  349   3   9   0 29.644  59.288   0.321    5.93    4       42.0        2.6
  350   4   6  -1 29.666  59.333   0.321    5.92    4       67.5        6.7
  351   1   0  -6 29.687  59.374   0.321    5.91    2       13.7        0.1
  352   0  11   2 29.699  59.397   0.322    5.91    4      118.5       20.5
  353   3   5  -4 29.706  59.413   0.322    5.9     4       32.4        1.5
  354   4   6   1 29.767  59.533   0.322    5.88    4       38.8        2.2
  355   4   3  -3 29.793  59.586   0.323    5.86    4        6.2        0.1
  356   4   5   2 29.796  59.593   0.323    5.86    4       79.9        9.2
  357   1   1  -6 29.808  59.615   0.323    5.86    4       14.6        0.3
  358   3   7   3 29.816  59.632   0.323    5.85    4       51.4        3.8
  359   1   0   6 29.837  59.675   0.323    5.84    2       52.8        2.0
  360   2   9  -3 29.87   59.74    0.323    5.83    4        8.1        0.1
  361   1   1   6 29.957  59.915   0.324    5.79    4       24.6        0.9


  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   4.884   9.768  9.047        451.7     78.2     78.5     5.6
    2   0   1   1   5.245  10.489  8.42697      232.2     40.2     40.3     5.6
    3   0   3   1   8.695  17.39   5.09533      577.8    100.0    100.0     5.6
    4   1   2   1   9.07   18.14   4.88618       20.0      3.5      3.5     5.6
    5   0   0   2   9.31   18.62   4.7614        22.4      3.9      3.9     5.6
    6   1   3   0   9.49   18.979  4.67205        8.7      1.5      1.5     5.6
    7   0   4   0   9.804  19.609  4.5235        20.1      3.5      3.5     5.6
    8   0   2   2  10.534  21.067  4.21349      137.4     23.8     23.7     5.6
    9   1   0   2  11.154  22.307  3.98198       13.3      2.3      2.3     5.6
   10   1   1  -2  11.312  22.625  3.92682       38.3      6.6      6.6     5.6
   11   1   1   2  11.424  22.848  3.88892       41.0      7.1      7.1     5.6
   12   1   4   0  11.518  23.035  3.85777       44.3      7.7      7.6     5.6
   13   0   3   2  11.895  23.789  3.7372       130.5     22.6     22.5     5.6
   14   2   0   0  12.036  24.073  3.69382      386.0     66.8     66.5     5.6
   15   1   2  -2  12.097  24.193  3.67571       30.1      5.2      5.2     5.6
   16   2   1   0  12.288  24.577  3.61917        8.3      1.4      1.4     5.6
   17   1   4  -1  12.415  24.83   3.58279       35.4      6.1      6.1     5.6
   18   2   2   0  13.017  26.034  3.41976      332.8     57.6     57.2     5.6
   19   2   1  -1  13.112  26.224  3.39545       40.3      7.0      6.9     5.6
   20   0   5   1  13.162  26.324  3.38278       58.4     10.1     10.0     5.6
   21   2   1   1  13.209  26.419  3.37086       34.3      5.9      5.9     5.6
   22   1   3   2  13.403  26.806  3.32307       10.1      1.8      1.7     5.6
   23   0   4   2  13.584  27.169  3.27948       26.0      4.5      4.5     5.6
   24   2   2   1  13.893  27.786  3.20798       13.6      2.4      2.3     5.6
   25   0   1   3  14.263  28.526  3.12652      149.7     25.9     25.7     5.6
   26   0   6   0  14.799  29.598  3.01567       33.1      5.7      5.7     5.6
   27   0   2   3  14.902  29.804  2.99525      209.9     36.3     36.0     5.6
   28   1   4   2  14.934  29.869  2.9889        18.4      3.2      3.1     5.6
   29   1   1  -3  15.454  30.908  2.89072       10.8      1.9      1.9     5.6
   30   0   5   2  15.507  31.014  2.88111      131.6     22.8     22.5     5.6
   31   0   6   1  15.541  31.082  2.87495       62.5     10.8     10.7     5.6
   32   2   4   0  15.618  31.236  2.8611         9.4      1.6      1.6     5.6
   33   1   6   0  16.015  32.03   2.79201       49.3      8.5      8.4     5.6
   34   1   2  -3  16.05   32.1    2.78603       11.8      2.0      2.0     5.6
   35   2   2   2  16.181  32.362  2.76408       15.6      2.7      2.7     5.6
   36   1   5  -2  16.637  33.274  2.69037       13.9      2.4      2.4     5.6
   37   1   6  -1  16.689  33.378  2.68229        8.6      1.5      1.5     5.7
   38   1   6   1  16.728  33.456  2.67618       18.1      3.1      3.1     5.7
   39   2   3  -2  16.973  33.945  2.63872        8.8      1.5      1.5     5.7
   40   1   3  -3  17.002  34.004  2.63426        6.9      1.2      1.2     5.7
   41   2   3   2  17.127  34.253  2.61569        5.9      1.0      1.0     5.7
   42   0   6   2  17.599  35.197  2.54767       52.5      9.1      9.0     5.7
   43   2   5  -1  17.948  35.896  2.49966       80.1     13.9     13.7     5.7
   44   0   7   1  17.986  35.971  2.49459        8.0      1.4      1.4     5.7
   45   2   5   1  18.022  36.043  2.4898        77.3     13.4     13.2     5.7
   46   2   4  -2  18.233  36.467  2.46182        7.4      1.3      1.3     5.7
   47   1   4   3  18.37   36.74   2.44418       16.3      2.8      2.8     5.7
   48   0   5   3  18.832  37.663  2.38632       14.8      2.6      2.5     5.7
   49   0   0   4  18.878  37.756  2.3807        14.8      2.6      2.5     5.7
   50   3   1  -1  18.966  37.933  2.37001       20.2      3.5      3.4     5.7
   51   1   7  -1  19.003  38.006  2.36558       11.7      2.0      2.0     5.7
   52   0   1   4  19.047  38.094  2.36036       77.8     13.5     13.2     5.7
   53   2   6   0  19.253  38.506  2.33603       27.6      4.8      4.7     5.7
   54   3   2  -1  19.467  38.935  2.31127        6.9      1.2      1.2     5.7
   55   2   5  -2  19.752  39.504  2.27927       32.8      5.7      5.6     5.7
   56   2   5   2  19.887  39.775  2.26437       32.5      5.6      5.5     5.7
   57   1   1   4  20.102  40.204  2.2412         7.9      1.4      1.3     5.7
   58   3   3  -1  20.279  40.559  2.22239       16.8      2.9      2.9     5.7
   59   0   6   3  20.629  41.258  2.18632       13.5      2.3      2.3     5.7
   60   3   4   0  20.864  41.727  2.16283       17.4      3.0      2.9     5.7
   61   3   2  -2  21.146  42.291  2.13528        6.8      1.2      1.2     5.7
   62   3   4  -1  21.373  42.746  2.11359        7.2      1.2      1.2     5.7
   63   0   4   4  21.446  42.892  2.10674       23.1      4.0      3.9     5.7
   64   2   6  -2  21.485  42.97   2.1031        12.6      2.2      2.1     5.7
   65   2   6   2  21.612  43.223  2.09138       22.5      3.9      3.8     5.7
   66   3   3  -2  21.906  43.812  2.06461        6.0      1.0      1.0     5.7
   67   3   3   2  22.093  44.185  2.04804       16.5      2.8      2.8     5.7
   68   0   8   2  22.15   44.301  2.04297        6.3      1.1      1.1     5.7
   69   2   1  -4  22.664  45.328  1.99903       12.9      2.2      2.2     5.7
   70   2   1   4  22.906  45.812  1.97904        6.6      1.1      1.1     5.7
   71   2   2  -4  23.099  46.198  1.96341       38.1      6.6      6.4     5.7
   72   2   2   4  23.337  46.674  1.94446       22.5      3.9      3.8     5.7
   73   1   7  -3  23.421  46.842  1.93789        6.3      1.1      1.1     5.7
   74   2   8   0  23.537  47.074  1.92888       27.6      4.8      4.7     5.7
   75   3   6   0  23.818  47.637  1.9074        32.0      5.5      5.4     5.7
   76   0   1   5  23.996  47.992  1.8941        32.1      5.6      5.4     5.7
   77   2   6  -3  24.081  48.162  1.88783       13.5      2.3      2.3     5.7
   78   2   6   3  24.254  48.508  1.87514       17.0      2.9      2.9     5.7
   79   3   6   1  24.365  48.73   1.86714        7.4      1.3      1.2     5.7
   80   4   0   0  24.649  49.299  1.84691       65.0     11.2     10.9     5.7
   81   0   8   3  24.72   49.439  1.84199       12.3      2.1      2.1     5.7
   82   2   4   4  25.005  50.01   1.82229        6.4      1.1      1.1     5.7
   83   0  10   0  25.196  50.391  1.8094         8.0      1.4      1.3     5.8
   84   1   8  -3  25.488  50.976  1.79          13.5      2.3      2.3     5.8
   85   3   7   0  25.596  51.192  1.78296        6.3      1.1      1.1     5.8
   86   0  10   1  25.679  51.358  1.7776        41.5      7.2      7.0     5.8
   87   1   3  -5  25.828  51.656  1.76802       20.0      3.5      3.4     5.8
   88   1  10   0  25.995  51.99   1.75746       11.0      1.9      1.8     5.8
   89   3   7   1  26.115  52.23   1.74994        8.5      1.5      1.4     5.8
   90   4   3  -1  26.281  52.561  1.7397        10.3      1.8      1.7     5.8
   91   4   3   1  26.389  52.778  1.73305        8.6      1.5      1.4     5.8
   92   4   4   0  26.775  53.55   1.70988       10.3      1.8      1.7     5.8
   93   3   1   4  27.035  54.07   1.69466        6.4      1.1      1.1     5.8
   94   0   5   5  27.196  54.392  1.68539       11.5      2.0      1.9     5.8
   95   4   4   1  27.291  54.583  1.67995        6.8      1.2      1.1     5.8
   96   2   6  -4  27.409  54.817  1.67331       22.2      3.8      3.7     5.8
   97   2   6   4  27.619  55.239  1.66153       17.4      3.0      2.9     5.8
   98   1   5   5  28.02   56.04   1.63967        7.6      1.3      1.3     5.8
   99   4   5  -1  28.319  56.638  1.62375        8.2      1.4      1.4     5.8
  100   0  11   1  28.373  56.747  1.62091        8.5      1.5      1.4     5.8
  101   2  10  -1  28.718  57.436  1.60308        7.4      1.3      1.2     5.8
  102   2  10   1  28.769  57.539  1.60047        7.4      1.3      1.2     5.8
  103   4   1  -3  28.82   57.64   1.5979         8.1      1.4      1.3     5.8
  104   4   1   3  29.126  58.251  1.58258        8.8      1.5      1.5     5.8
  105   0   1   6  29.156  58.312  1.58106       17.9      3.1      3.0     5.8
  106   4   5  -2  29.596  59.191  1.55966        6.8      1.2      1.1     5.8
  107   4   6  -1  29.666  59.333  1.55628        9.3      1.6      1.5     5.8
  108   0  11   2  29.699  59.397  1.55475       22.0      3.8      3.7     5.8
  109   4   5   2  29.796  59.593  1.55011       13.4      2.3      2.2     5.8

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)