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       ***
                  ***********************
ARMENITE

1, t-armenite, f-osumilite, DF

BaCa(2)Al(6)Si(9)O(30).2H(2)O


Hexagonal  P 6/mcc  Z = 2

R =0.077          NR =172

17 .11 .1992

Ref.Str.:

         Bakakin V.V., Balko V.P., Solovyeva L.P. (1974)

         * Kristallogr., 19, 741-745

                   Initial data from BDM-file 

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

             a =  10.69     alpha =   90.0 
             b =  10.69     beta  =   90.0 
             c =  13.9      gamma =  120.0 

    Unit cell volume (cub. angs.) =  1375.63

    Molar volume ( cub.cm/mol.) =   414.3 

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

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

   1 0.0     0.0     0.25     1.1    Ba    = 1.00
   2 0.3333  0.6667  0.25     1.3    Ca    = 1.00
   3 0.0     0.5     0.25     0.9    Al    = 1.00
   4 0.083   0.3333  0.118    1.2    Si    = 0.75, Al    = 0.25
   5 0.098   0.378   0.0      3.0    O     = 1.00
   6 0.199   0.278   0.145    4.3    O     = 1.00
   7 0.116   0.473   0.178    2.9    O     = 1.00
   8 0.3333  0.6667  0.07     3.6    H(2)O = 0.5 , H(2)O = 0.0 


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.0        0.0        0.25  
     2       2     0.3333     0.6667     0.25  
     3       3     0.0        0.5        0.25  
     4       4     0.083      0.3333     0.118 
     5       5     0.098      0.378      0.0   
     6       6     0.199      0.278      0.145 
     7       7     0.116      0.473      0.178 
     8       8     0.3333     0.6667     0.07  
     9       3     0.5        0.5        0.25  
    10       3     0.5        0.0        0.25  
    11       4     0.6667     0.7497     0.118 
    12       4     0.2503     0.917      0.118 
    13       5     0.622      0.72       0.0   
    14       5     0.28       0.902      0.0   
    15       6     0.722      0.921      0.145 
    16       6     0.079      0.801      0.145 
    17       7     0.527      0.643      0.178 
    18       7     0.357      0.884      0.178 
    19       2     0.6667     0.3333     0.25  
    20       4     0.917      0.6667     0.118 
    21       5     0.902      0.622      0.0   
    22       6     0.801      0.722      0.145 
    23       7     0.884      0.527      0.178 
    24       8     0.6667     0.3333     0.07  
    25       4     0.3333     0.2503     0.118 
    26       4     0.7497     0.083      0.118 
    27       5     0.378      0.28       0.0   
    28       5     0.72       0.098      0.0   
    29       6     0.278      0.079      0.145 
    30       6     0.921      0.199      0.145 
    31       7     0.473      0.357      0.178 
    32       7     0.643      0.116      0.178 
    33       1     0.0        0.0        0.75  
    34       2     0.3333     0.6667     0.75  
    35       3     0.0        0.5        0.75  
    36       4     0.083      0.7497     0.618 
    37       5     0.098      0.72       0.5   
    38       6     0.199      0.921      0.645 
    39       7     0.116      0.643      0.678 
    40       8     0.3333     0.6667     0.57  
    41       3     0.5        0.0        0.75  
    42       3     0.5        0.5        0.75  
    43       4     0.6667     0.917      0.618 
    44       4     0.2503     0.3333     0.618 
    45       5     0.622      0.902      0.5   
    46       5     0.28       0.378      0.5   
    47       6     0.722      0.801      0.645 
    48       6     0.079      0.278      0.645 
    49       7     0.527      0.884      0.678 
    50       7     0.357      0.473      0.678 
    51       2     0.6667     0.3333     0.75  
    52       4     0.917      0.2503     0.618 
    53       5     0.902      0.28       0.5   
    54       6     0.801      0.079      0.645 
    55       7     0.884      0.357      0.678 
    56       8     0.6667     0.3333     0.57  
    57       4     0.3333     0.083      0.618 
    58       4     0.7497     0.6667     0.618 
    59       5     0.378      0.098      0.5   
    60       5     0.72       0.622      0.5   
    61       6     0.278      0.199      0.645 
    62       6     0.921      0.722      0.645 
    63       7     0.473      0.116      0.678 
    64       7     0.643      0.527      0.678 
    65       4     0.083      0.3333     0.882 
    66       6     0.199      0.278      0.855 
    67       7     0.116      0.473      0.822 
    68       8     0.3333     0.6667     0.93  
    69       4     0.6667     0.7497     0.882 
    70       4     0.2503     0.917      0.882 
    71       6     0.722      0.921      0.855 
    72       6     0.079      0.801      0.855 
    73       7     0.527      0.643      0.822 
    74       7     0.357      0.884      0.822 
    75       4     0.917      0.6667     0.882 
    76       6     0.801      0.722      0.855 
    77       7     0.884      0.527      0.822 
    78       8     0.6667     0.3333     0.93  
    79       4     0.3333     0.2503     0.882 
    80       4     0.7497     0.083      0.882 
    81       6     0.278      0.079      0.855 
    82       6     0.921      0.199      0.855 
    83       7     0.473      0.357      0.822 
    84       7     0.643      0.116      0.822 
    85       4     0.083      0.7497     0.382 
    86       6     0.199      0.921      0.355 
    87       7     0.116      0.643      0.322 
    88       8     0.3333     0.6667     0.43  
    89       4     0.6667     0.917      0.382 
    90       4     0.2503     0.3333     0.382 
    91       6     0.722      0.801      0.355 
    92       6     0.079      0.278      0.355 
    93       7     0.527      0.884      0.322 
    94       7     0.357      0.473      0.322 
    95       4     0.917      0.2503     0.382 
    96       6     0.801      0.079      0.355 
    97       7     0.884      0.357      0.322 
    98       8     0.6667     0.3333     0.43  
    99       4     0.3333     0.083      0.382 
   100       4     0.7497     0.6667     0.382 
   101       6     0.278      0.199      0.355 
   102       6     0.921      0.722      0.355 
   103       7     0.473      0.116      0.322 
   104       7     0.643      0.527      0.322 


X-ray density (g/cm cub.)   =      2.77

MU (1/cm) =     211.002    Mass attenuation coefficient (cm**2/g) =     76.146

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

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

    1    Ba                  3.456       12
                                                 3.0274       6
                                                 3.0274       6
                                                 3.0275       6
                                                 3.0274       6
                                                 3.0274       6
                                                 3.0275       6
                                                 3.0274       6
                                                 3.0274       6
                                                 3.0275       6
                                                 3.0274       6
                                                 3.0274       6
                                                 3.0275       6
    2    Ca                  3.048        8
                                                 2.4239       7
                                                 2.502        8
                                                 2.4241       7
                                                 2.4239       7
                                                 2.4239       7
                                                 2.502        8
                                                 2.424        7
                                                 2.424        7
    3    Al                  2.484        4
                                                 1.7264       7
                                                 1.7264       7
                                                 1.7264       7
                                                 1.7264       7
    4   Si   ,Al             2.484        4
                                                 1.6933       5
                                                 1.6619       6
                                                 1.5883       7
                                                 1.6478       6
    5    O                   3.432        8
                                                 2.7432       6
                                                 2.6447       7
                                                 3.0058       8
                                                 2.7719       6
                                                 2.7432       6
                                                 2.6447       7
                                                 3.0058       8
                                                 2.7719       6
    6    O                   3.432        9
                                                 2.7432       5
                                                 2.6819       7
                                                 2.7718       5
                                                 2.6523       6
                                                 2.6525       6
                                                 2.6513       7
                                                 3.1884       6
                                                 3.1194       7
                                                 3.265        6
    7    O                   3.432        9
                                                 2.6447       5
                                                 2.6819       6
                                                 2.6697       8
                                                 2.8135       7
                                                 2.6513       6
                                                 2.7035       7
                                                 3.1193       6
                                                 3.2625       7
                                                 2.9359       7
    8   H(2)O,H(2)O          3.6          7
                                                 3.0058       5
                                                 2.6697       7
                                                 3.0059       5
                                                 3.0057       5
                                                 2.6698       7
                                                 2.6697       7
                                                 1.946        8

  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   1   0   0  4.773   9.545   0.054  285.92    6       71.8      467.1
    2   0   0   2  6.363  12.727   0.072  159.85    2      269.6     1227.9
    3   1   0   2  7.966  15.932   0.09   101.18   12       33.5       72.0
    4   1   1   0  8.286  16.572   0.094   93.36    6       44.6       58.9
    5   2   0   0  9.579  19.158   0.108   69.3     6       12.3        3.3
    6   1   1   2 10.475  20.949   0.118   57.6    12      142.5      741.5
    7   2   0   2 11.533  23.067   0.13    47.14   12      166.9      832.8
    8   2   1   0 12.717  25.434   0.143   38.41   12       41.4       41.8
    9   0   0   4 12.807  25.613   0.144   37.84    2      129.4       67.0
   10   2   1   1 13.121  26.241   0.147   35.96   24      134.6      825.9
   11   1   0   4 13.696  27.391   0.154   32.84   12       22.5       10.6
   12   2   1   2 14.268  28.536   0.16    30.1    24       27.9       29.7
   13   3   0   0 14.454  28.909   0.162   29.28    6      221.6      455.8
   14   1   1   4 15.331  30.662   0.172   25.81   12      232.5      884.4
   15   3   0   2 15.849  31.699   0.177   24.03   12       67.7       69.8
   16   2   1   3 16.013  32.026   0.179   23.5    24       71.8      153.8
   17   2   0   4 16.092  32.183   0.18    23.25   12      215.3      683.7
   18   2   2   0 16.752  33.503   0.187   21.31    6      240.0      389.2
   19   3   1   0 17.457  34.914   0.195   19.48   12      120.7      179.9
   20   3   1   1 17.762  35.525   0.198   18.76   24       76.4      139.0
   21   2   2   2 17.987  35.974   0.2     18.25   12      159.6      294.9
   22   2   1   4 18.204  36.408   0.203   17.77   24       61.6       85.5
   23   3   1   2 18.652  37.303   0.208   16.85   24       53.3       60.7
   24   0   0   6 19.42   38.841   0.216   15.41    2       26.9        1.2
   25   4   0   0 19.44   38.879   0.216   15.38    6       59.3       17.2
   26   3   0   4 19.501  39.002   0.217   15.27   12       70.8       48.5
   27   1   0   6 20.044  40.089   0.222   14.36   12       41.3       15.5
   28   3   1   3 20.058  40.117   0.223   14.34   24       36.6       24.3
   29   4   0   2 20.535  41.07    0.228   13.61   12      109.2      102.8
   30   2   1   5 20.725  41.45    0.23    13.33   24        9.4        1.5
   31   1   1   6 21.247  42.493   0.235   12.61   12      152.6      186.1
   32   3   2   0 21.265  42.529   0.235   12.59   12        3.6        0.1
   33   2   2   4 21.322  42.643   0.236   12.51   12      127.7      129.3
   34   3   2   1 21.524  43.047   0.238   12.25   24       30.6       14.6
   35   2   0   6 21.827  43.655   0.241   11.87   12       85.8       55.4
   36   3   1   4 21.901  43.802   0.242   11.78   24       33.4       16.7
   37   3   2   2 22.286  44.572   0.246   11.33   24       67.7       65.9
   38   4   1   0 22.413  44.827   0.247   11.18   12      153.9      168.1
   39   4   1   1 22.662  45.324   0.25    10.91   24       35.7       17.7
   40   4   1   2 23.395  46.79    0.258   10.15   24      129.0      214.1
   41   2   1   6 23.501  47.002   0.259   10.05   24       24.2        7.4
   42   3   2   3 23.513  47.027   0.259   10.04   24       29.2       10.9
   43   4   0   4 23.57   47.141   0.26     9.98   12       74.9       35.5
   44   3   1   5 24.103  48.205   0.265    9.49   24      113.3      154.4
   45   3   0   6 24.567  49.135   0.27     9.08   12      137.7      109.2
   46   4   1   3 24.579  49.159   0.27     9.07   24        5.3        0.3
   47   5   0   0 24.583  49.167   0.27     9.07    6      131.2       49.5
   48   3   2   4 25.154  50.308   0.276    8.61   24       46.8       23.9
   49   5   0   2 25.501  51.002   0.279    8.34   12       32.2        5.5
   50   3   3   0 25.616  51.232   0.281    8.26    6        6.3        0.1
   51   2   2   6 26.106  52.212   0.286    7.91   12      195.1      190.9
   52   4   2   0 26.121  52.242   0.286    7.9    12      113.4       64.5
   53   4   1   4 26.17   52.34    0.286    7.87   24      113.3      128.1
   54   0   0   8 26.316  52.633   0.288    7.77    2      328.9       88.8
   55   4   2   1 26.343  52.686   0.288    7.75   24       78.8       61.0
   56   2   1   7 26.489  52.977   0.29     7.65   24       42.7       17.7
   57   3   3   2 26.508  53.015   0.29     7.64   12       85.7       35.6
   58   3   1   6 26.604  53.209   0.291    7.58   24       17.8        3.0
   59   1   0   8 26.812  53.624   0.293    7.44   12       90.2       38.4
   60   4   2   2 27.001  54.002   0.295    7.33   24       58.7       32.0
   61   3   2   5 27.155  54.311   0.296    7.23   24       32.0        9.4
   62   5   1   0 27.597  55.195   0.301    6.97   12       47.9       10.2
   63   1   1   8 27.785  55.571   0.303    6.86   12        2.7        0.0
   64   5   1   1 27.811  55.622   0.303    6.85   24       37.9       12.5
   65   4   0   6 28.063  56.126   0.305    6.71   12      113.1       54.4
   66   4   2   3 28.074  56.148   0.305    6.71   24       40.9       14.2
   67   4   1   5 28.121  56.241   0.306    6.68   24       10.7        1.0
   68   5   0   4 28.124  56.249   0.306    6.68   12      118.1       59.0
   69   2   0   8 28.264  56.527   0.307    6.6    12        0.7        0.0
   70   5   1   2 28.446  56.892   0.309    6.51   24       10.4        0.9
   71   3   3   4 29.068  58.136   0.315    6.2    12      154.3       93.6
   72   3   1   7 29.365  58.731   0.318    6.06   24       33.7        8.7
   73   3   2   6 29.474  58.947   0.319    6.01   24        5.5        0.2
   74   5   1   3 29.484  58.968   0.319    6.0    24       43.2       14.2
   75   4   2   4 29.533  59.066   0.32     5.98   24       89.4       60.6
   76   2   1   8 29.668  59.336   0.321    5.92   24       39.6       11.8
   77   6   0   0 29.948  59.897   0.324    5.8     6       81.3       12.2
   78   4   1   6 30.391  60.782   0.328    5.61   24       53.5       20.4
   79   4   3   0 30.405  60.81    0.329    5.6    12       12.3        0.5
   80   3   0   8 30.582  61.163   0.33     5.53   12      151.8       80.8
   81   4   3   1 30.606  61.212   0.33     5.52   24       29.0        5.9
   82   6   0   2 30.755  61.511   0.332    5.46   12      163.9       93.1
   83   5   1   4 30.901  61.802   0.333    5.41   24       26.6        4.8
   84   4   3   2 31.205  62.41    0.336    5.29   24       54.0       19.6
   85   5   2   0 31.306  62.611   0.337    5.25   12      223.4      166.3
   86   4   2   5 31.346  62.692   0.338    5.24   24       75.6       38.0
   87   5   2   1 31.504  63.007   0.339    5.18   24       33.2        7.2
   88   2   2   8 31.923  63.847   0.343    5.03   12      183.6      107.6
   89   3   2   7 32.076  64.152   0.345    4.98   24       22.3        3.1
   90   5   2   2 32.093  64.186   0.345    4.97   24       54.2       18.5
   91   5   0   6 32.179  64.357   0.346    4.95   12       46.6        6.8
   92   4   3   3 32.189  64.378   0.346    4.94   24       41.6       10.8
   93   3   1   8 32.364  64.727   0.347    4.88   24       69.2       29.6
   94   5   1   5 32.67   65.339   0.35     4.79   24       32.4        6.4
   95   4   1   7 32.951  65.902   0.353    4.7    24       38.9        9.0
   96   2   1   9 33.036  66.072   0.354    4.67   24       51.1       15.5
   97   3   3   6 33.052  66.105   0.354    4.67   12      112.4       37.4
   98   5   2   3 33.062  66.125   0.354    4.67   24       12.8        1.0
   99   6   1   0 33.066  66.131   0.354    4.66   12       63.3       11.9
  100   6   0   4 33.108  66.216   0.355    4.65   12      187.7      103.9
  101   6   1   1 33.258  66.516   0.356    4.61   24       42.6       10.6
  102   4   2   6 33.485  66.97    0.358    4.54   24       84.4       41.1
  103   4   3   4 33.54   67.08    0.359    4.53   24       39.1        8.8
  104   0   0  10 33.653  67.306   0.36     4.49    2       77.0        2.8
  105   4   0   8 33.666  67.332   0.36     4.49   12       99.5       28.2
  106   6   1   2 33.831  67.662   0.361    4.44   24       42.0        9.9
  107   1   0  10 34.081  68.163   0.364    4.38   12       37.3        3.9
  108   5   2   4 34.396  68.792   0.367    4.29   24       29.5        4.8
  109   5   1   6 34.766  69.532   0.37     4.2    24       32.0        5.5
  110   6   1   3 34.776  69.552   0.37     4.2    24       23.6        3.0
  111   1   1  10 34.931  69.862   0.372    4.16   12      108.8       31.2
  112   3   2   8 34.944  69.888   0.372    4.16   24        7.4        0.3
  113   4   4   0 35.201  70.402   0.374    4.1     6       45.8        2.7
  114   4   3   5 35.239  70.478   0.375    4.09   24        7.2        0.3
  115   2   0  10 35.352  70.705   0.376    4.06   12       84.9       18.6
  116   3   1   9 35.592  71.185   0.378    4.01   24      133.7       90.9
  117   5   3   0 35.621  71.242   0.378    4.0    12        1.7        0.0
  118   7   0   0 35.621  71.242   0.378    4.0     6       74.2        7.0
  119   4   1   8 35.784  71.569   0.38     3.97   24       27.9        3.9
  120   5   3   1 35.807  71.613   0.38     3.96   24       19.6        1.9
  121   4   2   7 35.929  71.858   0.381    3.93   24       48.5       11.7
  122   4   4   2 35.945  71.89    0.381    3.93   12      126.6       39.9
  123   5   2   5 36.076  72.153   0.382    3.9    24       14.5        1.0
  124   6   1   4 36.08   72.159   0.382    3.9    24        5.7        0.2
  125   5   3   2 36.361  72.722   0.385    3.84   24       28.1        3.9
  126   7   0   2 36.361  72.722   0.385    3.84   12       22.8        1.3
  127   2   1  10 36.604  73.208   0.387    3.8    24        5.7        0.2
  128   6   0   6 36.856  73.713   0.389    3.75   12      129.4       39.8
  129   6   2   0 36.869  73.738   0.389    3.74   12      133.4       42.2
  130   6   2   1 37.052  74.104   0.391    3.71   24       73.7       25.5
  131   5   1   7 37.173  74.345   0.392    3.69   24       15.0        1.0
  132   4   3   6 37.269  74.537   0.393    3.67   24       19.4        1.8
  133   5   3   3 37.278  74.556   0.393    3.67   24       26.0        3.2
  134   3   0  10 37.429  74.858   0.395    3.64   12       48.8        5.5
  135   5   0   8 37.442  74.883   0.395    3.64   12       26.8        1.7
  136   6   2   2 37.599  75.199   0.396    3.61   24       99.5       45.3
  137   6   1   5 37.729  75.458   0.397    3.59   24       49.1       11.0
  138   3   2   9 38.073  76.146   0.4      3.53   24       21.5        2.1
  139   5   2   6 38.089  76.177   0.4      3.53   24      108.9       53.1
  140   4   4   4 38.141  76.282   0.401    3.52   12      205.2       94.0
  141   3   3   8 38.26   76.521   0.402    3.5    12       27.5        1.7
  142   6   2   3 38.506  77.012   0.404    3.46   24       77.1       26.1
  143   5   3   4 38.549  77.097   0.405    3.46   24       28.1        3.5
  144   7   0   4 38.549  77.097   0.405    3.46   12      102.4       23.0
  145   2   2  10 38.655  77.31    0.405    3.44   12      127.1       35.2
  146   4   2   8 38.668  77.335   0.406    3.44   24      117.9       60.6
  147   4   1   9 38.887  77.775   0.408    3.41   24       14.0        0.9
  148   7   1   0 38.915  77.831   0.408    3.4    12       47.3        4.8
  149   3   1  10 39.061  78.122   0.409    3.38   24       18.9        1.5
  150   7   1   1 39.095  78.19    0.409    3.38   24        9.2        0.4
  151   4   3   7 39.618  79.236   0.414    3.3    24        6.1        0.2
  152   7   1   2 39.633  79.267   0.414    3.3    24       57.6       13.9
  153   6   1   6 39.712  79.424   0.415    3.29   24       21.5        1.9
  154   6   2   4 39.764  79.528   0.415    3.28   24       19.1        1.5
  155   5   1   8 39.882  79.764   0.416    3.27   24       58.1       14.0
  156   5   3   5 40.164  80.327   0.419    3.23   24       26.2        2.8
  157   4   0  10 40.272  80.544   0.42     3.22   12       87.2       15.5
  158   2   1  11 40.399  80.798   0.421    3.21   24       23.1        2.2
  159   5   2   7 40.423  80.847   0.421    3.2    24       24.2        2.4
  160   7   1   3 40.526  81.053   0.422    3.19   24       20.9        1.8
  161   5   4   0 40.529  81.059   0.422    3.19   12       13.4        0.4
  162   5   4   1 40.707  81.415   0.423    3.17   24       25.7        2.7
  163   5   4   2 41.241  82.481   0.428    3.11   24       13.9        0.8
  164   6   3   0 41.331  82.662   0.429    3.1    12       47.7        4.5
  165   6   2   5 41.367  82.733   0.429    3.1    24       40.2        6.3
  166   3   2  10 41.475  82.949   0.43     3.09   24       48.5        9.2
  167   6   3   1 41.508  83.016   0.43     3.09   24       16.5        1.1
  168   0   0  12 41.682  83.363   0.432    3.07    2       44.4        0.6
  169   4   2   9 41.703  83.406   0.432    3.07   24       72.4       20.4
  170   4   4   6 41.718  83.436   0.432    3.06   12      110.1       23.6
  171   8   0   0 41.73   83.461   0.432    3.06    6       83.3        6.7
  172   7   1   4 41.769  83.539   0.432    3.06   24       94.6       34.8
  173   6   0   8 41.886  83.772   0.433    3.05   12       42.6        3.5
  174   6   1   7 42.024  84.048   0.435    3.04   24       33.1        4.2
  175   6   3   2 42.039  84.079   0.435    3.03   24       78.1       23.5
  176   1   0  12 42.081  84.161   0.435    3.03   12        0.6        0.0
  177   5   3   6 42.117  84.234   0.435    3.03   24       29.9        3.4
  178   7   0   6 42.117  84.234   0.435    3.03   12       23.5        1.1
  179   5   4   3 42.126  84.253   0.435    3.03   24        2.5        0.0
  180   4   1  10 42.273  84.545   0.437    3.01   24       78.0       23.3
  181   4   3   8 42.285  84.57    0.437    3.01   24        5.0        0.1
  182   8   0   2 42.438  84.876   0.438    3.0    12       73.0       10.1
  183   3   1  11 42.796  85.593   0.441    2.97   24       19.6        1.4
  184   1   1  12 42.877  85.754   0.442    2.96   12      109.0       22.3
  185   5   1   9 42.898  85.796   0.442    2.96   24       27.4        2.8
  186   6   3   3 42.923  85.845   0.442    2.96   24       26.4        2.6
  187   7   2   0 42.926  85.851   0.442    2.96   12        5.1        0.0
  188   5   2   8 43.081  86.161   0.443    2.95   24      168.6      106.2
  189   7   2   1 43.102  86.204   0.444    2.95   24       16.9        1.1
  190   2   0  12 43.275  86.549   0.445    2.93   12      107.8       21.6
  191   6   2   6 43.311  86.622   0.445    2.93   24       52.3       10.2
  192   7   1   5 43.359  86.718   0.446    2.93   24        9.4        0.3
  193   5   4   4 43.362  86.724   0.446    2.93   24       47.1        8.2
  194   7   2   2 43.631  87.261   0.448    2.91   24       29.3        3.2
  195   5   0  10 43.863  87.726   0.45     2.89   12       52.5        5.1
  196   6   3   4 44.156  88.312   0.452    2.87   24       93.4       31.8
  197   5   3   7 44.409  88.819   0.454    2.86   24       12.0        0.5
  198   2   1  12 44.465  88.931   0.455    2.86   24       22.7        1.9
  199   7   2   3 44.511  89.022   0.455    2.85   24       32.5        3.8
  200   8   0   4 44.553  89.105   0.455    2.85   12       79.9       11.5
  201   3   3  10 44.657  89.313   0.456    2.85   12       87.1       13.7
  202   6   1   8 44.669  89.337   0.456    2.85   24       36.3        4.8
  203   5   4   5 44.946  89.893   0.459    2.83   24       19.1        1.3


  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   1   0   0   4.773   9.545  9.25781      467.1     38.0     38.1     5.6
    2   0   0   2   6.363  12.727  6.95        1227.9    100.0    100.0     5.6
    3   1   0   2   7.966  15.932  5.55809       72.0      5.9      5.8     5.6
    4   1   1   0   8.286  16.572  5.345         58.9      4.8      4.8     5.6
    5   1   1   2  10.475  20.949  4.23692      741.5     60.4     60.1     5.6
    6   2   0   2  11.533  23.067  3.85261      832.8     67.8     67.4     5.6
    7   2   1   0  12.717  25.434  3.49912       41.8      3.4      3.4     5.6
    8   0   0   4  12.807  25.613  3.475         67.0      5.5      5.4     5.6
    9   2   1   1  13.121  26.241  3.39326      825.9     67.3     66.6     5.6
   10   2   1   2  14.268  28.536  3.12536       29.7      2.4      2.4     5.6
   11   3   0   0  14.454  28.909  3.08594      455.8     37.1     36.7     5.6
   12   1   1   4  15.331  30.662  2.9134       884.4     72.0     71.1     5.6
   13   3   0   2  15.849  31.699  2.82041       69.8      5.7      5.6     5.6
   14   2   1   3  16.013  32.026  2.79231      153.8     12.5     12.3     5.6
   15   2   0   4  16.092  32.183  2.77904      683.7     55.7     54.9     5.6
   16   2   2   0  16.752  33.503  2.6725       389.2     31.7     31.2     5.7
   17   3   1   0  17.457  34.914  2.56765      179.9     14.7     14.4     5.7
   18   3   1   1  17.762  35.525  2.52494      139.0     11.3     11.1     5.7
   19   2   2   2  17.987  35.974  2.49444      294.9     24.0     23.6     5.7
   20   2   1   4  18.204  36.408  2.46568       85.5      7.0      6.8     5.7
   21   3   1   2  18.652  37.303  2.40854       60.7      4.9      4.9     5.7
   22   4   0   0  19.44   38.879  2.31445       18.3      1.5      1.5     5.7
   23   3   0   4  19.501  39.002  2.30743       48.5      4.0      3.9     5.7
   24   3   1   3  20.058  40.117  2.24585       39.8      3.2      3.2     5.7
   25   4   0   2  20.535  41.07   2.19589      102.8      8.4      8.2     5.7
   26   1   1   6  21.247  42.493  2.1256       186.2     15.2     14.8     5.7
   27   2   2   4  21.322  42.643  2.11846      129.3     10.5     10.3     5.7
   28   3   2   1  21.524  43.047  2.09952       14.6      1.2      1.2     5.7
   29   2   0   6  21.827  43.655  2.07169       55.4      4.5      4.4     5.7
   30   3   1   4  21.901  43.802  2.06508       16.7      1.4      1.3     5.7
   31   3   2   2  22.286  44.572  2.03116       65.9      5.4      5.2     5.7
   32   4   1   0  22.413  44.827  2.02022      168.1     13.7     13.3     5.7
   33   4   1   1  22.662  45.324  1.99922       17.7      1.4      1.4     5.7
   34   4   1   2  23.395  46.79   1.93993      214.1     17.4     16.9     5.7
   35   3   2   3  23.513  47.027  1.93071       18.3      1.5      1.4     5.7
   36   4   0   4  23.57   47.141  1.92631       35.5      2.9      2.8     5.7
   37   3   1   5  24.103  48.205  1.88621      154.4     12.6     12.2     5.7
   38   3   0   6  24.567  49.135  1.8527       159.0     12.9     12.5     5.7
   39   3   2   4  25.154  50.308  1.81221       23.9      1.9      1.9     5.8
   40   2   2   6  26.106  52.212  1.75052      255.3     20.8     20.1     5.8
   41   4   1   4  26.17   52.34   1.74652      128.1     10.4     10.1     5.8
   42   0   0   8  26.316  52.633  1.7375       149.9     12.2     11.8     5.8
   43   3   3   2  26.508  53.015  1.72586       53.3      4.3      4.2     5.8
   44   1   0   8  26.812  53.624  1.70768       38.4      3.1      3.0     5.8
   45   4   2   2  27.001  54.002  1.69663       32.0      2.6      2.5     5.8
   46   5   1   1  27.811  55.622  1.65098       12.5      1.0      1.0     5.8
   47   4   0   6  28.063  56.126  1.63735       68.6      5.6      5.4     5.8
   48   5   0   4  28.124  56.249  1.63408       59.0      4.8      4.6     5.8
   49   3   3   4  29.068  58.136  1.58543       93.6      7.6      7.3     5.8
   50   5   1   3  29.484  58.968  1.56503       14.2      1.2      1.1     5.8
   51   4   2   4  29.533  59.066  1.56268       60.6      4.9      4.7     5.8
   52   4   1   6  30.391  60.782  1.5226        20.9      1.7      1.6     5.8
   53   3   0   8  30.582  61.163  1.51401       86.7      7.1      6.7     5.8
   54   6   0   2  30.755  61.511  1.50629       93.1      7.6      7.2     5.8
   55   4   3   2  31.205  62.41   1.48674       19.6      1.6      1.5     5.8
   56   5   2   0  31.306  62.611  1.48244      166.3     13.5     12.9     5.8
   57   4   2   5  31.346  62.692  1.48073       38.0      3.1      2.9     5.8
   58   2   2   8  31.923  63.847  1.4567       107.6      8.8      8.3     5.9
   59   5   2   2  32.093  64.186  1.44982       21.7      1.8      1.7     5.9
   60   4   3   3  32.189  64.378  1.44596       17.6      1.4      1.4     5.9
   61   3   1   8  32.364  64.727  1.439         29.6      2.4      2.3     5.9
   62   3   3   6  33.052  66.105  1.4123        65.7      5.3      5.1     5.9
   63   6   0   4  33.108  66.216  1.4102       103.9      8.5      8.0     5.9
   64   4   2   6  33.485  66.97   1.39615       41.1      3.3      3.2     5.9
   65   4   0   8  33.666  67.332  1.38952       31.0      2.5      2.4     5.9
   66   1   1  10  34.931  69.862  1.34525       31.5      2.6      2.4     5.9
   67   2   0  10  35.352  70.705  1.33127       18.6      1.5      1.4     5.9
   68   3   1   9  35.592  71.185  1.32347       97.9      8.0      7.5     5.9
   69   4   4   2  35.945  71.89   1.31222       51.7      4.2      3.9     5.9
   70   6   2   0  36.869  73.738  1.28383       82.0      6.7      6.2     6.0
   71   6   2   1  37.052  74.104  1.27839       25.5      2.1      1.9     6.0
   72   6   2   2  37.599  75.199  1.26247       45.3      3.7      3.4     6.0
   73   5   2   6  38.089  76.177  1.24867       55.1      4.5      4.2     6.0
   74   4   4   4  38.141  76.282  1.24722       94.0      7.7      7.1     6.0
   75   6   2   3  38.506  77.012  1.23721       26.1      2.1      2.0     6.0
   76   7   0   4  38.549  77.097  1.23605       26.5      2.2      2.0     6.0
   77   4   2   8  38.668  77.335  1.23284       95.8      7.8      7.2     6.0
   78   7   1   2  39.633  79.267  1.20758       13.9      1.1      1.0     6.0
   79   5   1   8  39.882  79.764  1.2013        14.0      1.1      1.1     6.0
   80   4   0  10  40.272  80.544  1.19161       15.5      1.3      1.2     6.1
   81   4   4   6  41.718  83.436  1.1575        50.7      4.1      3.8     6.1
   82   7   1   4  41.769  83.539  1.15635       34.8      2.8      2.6     6.1
   83   6   3   2  42.039  84.079  1.15029       27.7      2.3      2.1     6.1
   84   4   1  10  42.273  84.545  1.14513       23.3      1.9      1.7     6.1
   85   1   1  12  42.877  85.754  1.13206       25.2      2.0      1.9     6.1
   86   5   2   8  43.081  86.161  1.12774      107.3      8.7      7.9     6.1
   87   2   0  12  43.275  86.549  1.12369       21.6      1.8      1.6     6.1
   88   6   3   4  44.156  88.312  1.10575       31.8      2.6      2.3     6.2
   89   3   3  10  44.657  89.313  1.09593       18.5      1.5      1.4     6.2

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