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       ***
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VISHNEVITE

2, syn, f-feldspathoid, s-vishnevite, DF

[K(0.51)Na(3.25)Ca(0.06)][Si(3)Al(3)O(12)][SO(4)](0.24)


Hexagonal  P 6(3)  Z = 6

P6(3)

24 .1 .1907

Ref.Str.:

         Hassan I., Grundy H.D. (1984)

         * Canad. Mineral., 22, 333-349

Reserv:

         The positions of atoms Al and Si were traded places. N.A.D.

                   Initial data from BDM-file 

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

             a =  12.685    alpha =   90.0 
             b =  12.685    beta  =   90.0 
             c =   5.179    gamma =  120.0 

    Unit cell volume (cub. angs.) =   721.7 

    Molar volume ( cub.cm/mol.) =    72.45

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

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

   1 0.2017  0.4049  0.6698   0.0    O     = 1.00
   2 0.1175  0.5527  0.7278   0.0    O     = 1.00
   3 0.0406  0.3599  0.0393   0.0    O     = 1.00
   4 0.3255  0.3522  0.0561   0.0    O     = 1.00
   5 0.338   0.4137  0.7506   0.0    Al    = 1.00
   6 0.0831  0.4124  0.75     0.0    Si    = 1.00
   7 0.0615  0.1133  0.6725   0.0    O     = 0.24, O     = 0.0 
   8 0.0496  0.109   0.9541   0.0    O     = 0.24, O     = 0.0 
   9 0.0     0.0     0.2918   0.0    S     = 0.24, S     = 0.0 
  10 0.0     0.0     0.0737   0.0    O     = 0.24, O     = 0.0 
  11 0.6184  0.3043  0.6893   0.0    O     = 0.33, O     = 0.0 
  12 0.6667  0.3333  0.1272   0.0    Na    = 1.00
  13 0.1319  0.2611  0.2885   0.0    Na    = 0.75, K     = 0.17, Ca    = 0.02


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.2017     0.4049     0.6698
     2       2     0.1175     0.5527     0.7278
     3       3     0.0406     0.3599     0.0393
     4       4     0.3255     0.3522     0.0561
     5       5     0.338      0.4137     0.7506
     6       6     0.0831     0.4124     0.75  
     7       7     0.0615     0.1133     0.6725
     8       8     0.0496     0.109      0.9541
     9       9     0.0        0.0        0.2918
    10      10     0.0        0.0        0.0737
    11      11     0.6184     0.3043     0.6893
    12      12     0.6667     0.3333     0.1272
    13      13     0.1319     0.2611     0.2885
    14       1     0.5951     0.7968     0.6698
    15       1     0.2032     0.7983     0.6698
    16       2     0.4473     0.5648     0.7278
    17       2     0.4352     0.8825     0.7278
    18       3     0.6401     0.6807     0.0393
    19       3     0.3193     0.9594     0.0393
    20       4     0.6478     0.9733     0.0561
    21       4     0.0267     0.6745     0.0561
    22       5     0.5863     0.9243     0.7506
    23       5     0.0757     0.662      0.7506
    24       6     0.5876     0.6707     0.75  
    25       6     0.3293     0.9169     0.75  
    26       7     0.8867     0.9482     0.6725
    27       7     0.0518     0.9385     0.6725
    28       8     0.891      0.9406     0.9541
    29       8     0.0594     0.9504     0.9541
    30      11     0.6957     0.3141     0.6893
    31      11     0.6859     0.3816     0.6893
    32      13     0.7389     0.8708     0.2885
    33      13     0.1292     0.8681     0.2885
    34       1     0.7983     0.5951     0.1698
    35       2     0.8825     0.4473     0.2278
    36       3     0.9594     0.6401     0.5393
    37       4     0.6745     0.6478     0.5561
    38       5     0.662      0.5863     0.2506
    39       6     0.9169     0.5876     0.25  
    40       7     0.9385     0.8867     0.1725
    41       8     0.9504     0.891      0.4541
    42       9     0.0        0.0        0.7918
    43      10     0.0        0.0        0.5737
    44      11     0.3816     0.6957     0.1893
    45      12     0.3333     0.6667     0.6272
    46      13     0.8681     0.7389     0.7885
    47       1     0.4049     0.2032     0.1698
    48       1     0.7968     0.2017     0.1698
    49       2     0.5527     0.4352     0.2278
    50       2     0.5648     0.1175     0.2278
    51       3     0.3599     0.3193     0.5393
    52       3     0.6807     0.0406     0.5393
    53       4     0.3522     0.0267     0.5561
    54       4     0.9733     0.3255     0.5561
    55       5     0.4137     0.0757     0.2506
    56       5     0.9243     0.338      0.2506
    57       6     0.4124     0.3293     0.25  
    58       6     0.6707     0.0831     0.25  
    59       7     0.1133     0.0518     0.1725
    60       7     0.9482     0.0615     0.1725
    61       8     0.109      0.0594     0.4541
    62       8     0.9406     0.0496     0.4541
    63      11     0.3043     0.6859     0.1893
    64      11     0.3141     0.6184     0.1893
    65      13     0.2611     0.1292     0.7885
    66      13     0.8708     0.1319     0.7885


X-ray density (g/cm cub.)   =      2.32

MU (1/cm) =      82.411    Mass attenuation coefficient (cm**2/g) =     35.498

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

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

    1    O                   3.264        7
                                                 2.5978       2
                                                 2.6453       3
                                                 2.8223       4
                                                 3.2042       7
                                                 2.7552       2
                                                 2.8003       3
                                                 2.6149       4
    2    O                   3.264        8
                                                 2.5978       1
                                                 2.6739       3
                                                 2.7552       1
                                                 2.8955       4
                                                 2.903        3
                                                 2.6779       4
                                                 3.1904      11
                                                 3.2477      11
    3    O                   3.264        6
                                                 2.6453       1
                                                 2.6739       2
                                                 2.903        2
                                                 2.8004       1
                                                 2.7768       4
                                                 2.6095       4
    4    O                   3.264        6
                                                 2.8223       1
                                                 2.8955       2
                                                 2.6147       1
                                                 2.6779       2
                                                 2.6094       3
                                                 2.7767       3
    5    Al                  2.316        4
                                                 1.7274       1
                                                 1.7359       4
                                                 1.7182       2
                                                 1.7438       3
    6    Si                  2.1          4
                                                 1.6087       1
                                                 1.6107       2
                                                 1.6186       3
                                                 1.6212       4
    7   O    ,O              3.264       15
                                                 3.2042       1
                                                 1.4644       8
                                                 2.4229      10
                                                 2.1585       7
                                                 2.1585       7
                                                 2.6203       8
                                                 2.5185       8
                                                 2.6913       8
                                                 1.3471      10
                                                 2.8737       7
                                                 2.8737       7
                                                 2.8738       7
                                                 2.8738       7
                                                 1.588        8
                                                 1.7451       8
    8   O    ,O              3.264       14
                                                 1.4644       7
                                                 1.3496      10
                                                 2.5185       7
                                                 2.6203       7
                                                 2.0769       8
                                                 2.0769       8
                                                 2.6913       7
                                                 2.3063      10
                                                 1.7449       7
                                                 1.5881       7
                                                 2.8536       8
                                                 2.8536       8
                                                 2.8537       8
                                                 2.8537       8
    9   S    ,S              1.98         8
                                                 1.1295      10
                                                 1.3909       7
                                                 1.4643       8
                                                 1.46        10
                                                 1.3909       7
                                                 1.391        7
                                                 1.4643       8
                                                 1.4644       8
   10   O    ,O              3.264       14
                                                 2.4229       7
                                                 1.3496       8
                                                 2.4229       7
                                                 2.4229       7
                                                 1.3496       8
                                                 1.3497       8
                                                 1.3471       7
                                                 2.3063       8
                                                 2.5895      10
                                                 2.5895      10
                                                 1.3471       7
                                                 1.3472       7
                                                 2.3063       8
                                                 2.3063       8
   11   O    ,O              3.264        4
                                                 0.9247      11
                                                 0.9247      11
                                                 3.2479       2
                                                 3.1904       2
   12    Na                  2.808        6
                                                 2.3299      11
                                                 2.3299      11
                                                 2.3299      11
                                                 2.4288       2
                                                 2.429        2
                                                 2.4288       2
   13   Na   ,K    ,Ca       3.228       13
                                                 2.529        1
                                                 2.4554       3
                                                 2.4448       4
                                                 2.5677       7
                                                 2.4078       8
                                                 3.0765      10
                                                 3.2263      10
                                                 2.9089       3
                                                 2.8774       4
                                                 2.615        7
                                                 2.5103       7
                                                 2.5734       8
                                                 2.704        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  4.021   8.041   0.046  403.81    6        6.1       17.5
    2   1   1   0  6.976  13.951   0.079  132.64    6       55.2      466.2
    3   2   0   0  8.061  16.123   0.091   98.75    6       11.8       15.9
    4   1   0   1  9.464  18.928   0.107   71.05   12       65.8      708.9
    5   1   2   0 10.691  21.382   0.12    55.21    6       35.1       78.3
    6   2   1   0 10.691  21.382   0.12    55.21    6       12.0        9.2
    7   1   1   1 11.071  22.141   0.125   51.35   12        8.8        9.1
    8   2   0   1 11.795  23.591   0.133   44.98   12       10.7       11.9
    9   3   0   0 12.143  24.286   0.137   42.32    6       99.2      479.5
   10   1   2   1 13.755  27.51    0.154   32.53   12       77.9      454.3
   11   2   1   1 13.755  27.51    0.154   32.53   12       79.7      475.8
   12   2   2   0 14.057  28.115   0.158   31.07    6        4.4        0.7
   13   1   3   0 14.644  29.288   0.164   28.47    6       10.6        3.7
   14   3   1   0 14.644  29.288   0.164   28.47    6       14.5        6.9
   15   3   0   1 14.929  29.858   0.167   27.32   12       30.4       58.3
   16   4   0   0 16.288  32.577   0.182   22.65    6      106.2      294.2
   17   2   2   1 16.548  33.095   0.185   21.89   12        3.7        0.7
   18   1   3   1 17.057  34.113   0.19    20.49   12       40.6       77.7
   19   3   1   1 17.057  34.113   0.19    20.49   12       52.2      128.9
   20   0   0   2 17.305  34.611   0.193   19.86    2      187.8      268.9
   21   1   0   2 17.795  35.59    0.198   18.68   12       31.4       42.5
   22   2   3   0 17.796  35.593   0.198   18.68    6       29.8       19.1
   23   3   2   0 17.796  35.593   0.198   18.68    6       37.8       30.8
   24   4   0   1 18.51   37.02    0.206   17.13   12       85.0      285.3
   25   1   1   2 18.742  37.483   0.209   16.67   12       16.6       10.5
   26   1   4   0 18.743  37.485   0.209   16.67    6       24.1       11.2
   27   4   1   0 18.743  37.485   0.209   16.67    6       34.8       23.3
   28   2   0   2 19.2    38.399   0.213   15.8    12       11.0        4.4
   29   2   3   1 19.871  39.742   0.221   14.64   12       43.4       63.6
   30   3   2   1 19.871  39.742   0.221   14.64   12       37.5       47.4
   31   1   2   2 20.522  41.044   0.228   13.63   12       12.7        5.1
   32   2   1   2 20.522  41.044   0.228   13.63   12        9.5        2.9
   33   5   0   0 20.523  41.047   0.228   13.63    6       23.8        8.9
   34   1   4   1 20.737  41.473   0.23    13.32   12       39.8       48.6
   35   4   1   1 20.737  41.473   0.23    13.32   12       40.8       51.2
   36   3   0   2 21.366  42.732   0.236   12.45   12       59.1      100.3
   37   3   3   0 21.367  42.734   0.236   12.45    6      116.0      193.1
   38   2   4   0 21.779  43.558   0.241   11.93    6        5.4        0.4
   39   4   2   0 21.779  43.558   0.241   11.93    6       10.9        1.6
   40   5   0   1 22.385  44.77    0.247   11.22   12       47.7       58.8
   41   2   2   2 22.584  45.168   0.249   10.99   12       20.7       10.9
   42   1   3   2 22.978  45.957   0.253   10.57   12       15.3        5.7
   43   3   1   2 22.978  45.957   0.253   10.57   12       15.5        5.9
   44   1   5   0 22.979  45.959   0.253   10.57    6       15.5        2.9
   45   5   1   0 22.979  45.959   0.253   10.57    6       14.1        2.4
   46   3   3   1 23.174  46.349   0.255   10.37   12        3.2        0.2
   47   2   4   1 23.561  47.122   0.259    9.99   12        8.6        1.7
   48   4   2   1 23.561  47.122   0.259    9.99   12       15.7        5.6
   49   4   0   2 24.132  48.264   0.265    9.46   12       65.8       94.4
   50   1   5   1 24.694  49.388   0.271    8.98   12       11.1        2.6
   51   5   1   1 24.694  49.388   0.271    8.98   12       15.0        4.6
   52   6   0   0 24.879  49.758   0.273    8.83    6        7.5        0.6
   53   2   3   2 25.245  50.491   0.277    8.54   12       56.3       62.3
   54   3   2   2 25.245  50.491   0.277    8.54   12       52.3       53.8
   55   3   4   0 25.246  50.492   0.277    8.54    6       49.0       23.6
   56   4   3   0 25.246  50.492   0.277    8.54    6       37.3       13.6
   57   1   4   2 25.968  51.936   0.284    8.01   12       46.2       39.4
   58   4   1   2 25.968  51.936   0.284    8.01   12       52.7       51.3
   59   2   5   0 25.969  51.938   0.284    8.01    6       46.9       20.3
   60   5   2   0 25.969  51.938   0.284    8.01    6       67.4       41.8
   61   6   0   1 26.502  53.003   0.29     7.64   12       22.1        8.6
   62   1   0   3 26.851  53.702   0.293    7.42   12       37.8       24.5
   63   3   4   1 26.853  53.705   0.293    7.42   12       39.0       26.1
   64   4   3   1 26.853  53.705   0.293    7.42   12       28.4       13.8
   65   5   0   2 27.373  54.746   0.298    7.1    12       27.0       11.9
   66   1   6   0 27.374  54.747   0.298    7.1     6        0.8        0.0
   67   6   1   0 27.374  54.747   0.298    7.1     6        7.8        0.5
   68   1   1   3 27.544  55.088   0.3      7.0    12        5.8        0.6
   69   2   5   1 27.546  55.091   0.3      7.0    12       36.3       21.2
   70   5   2   1 27.546  55.091   0.3      7.0    12       44.4       31.8
   71   2   0   3 27.886  55.772   0.304    6.81   12       45.6       32.6
   72   3   3   2 28.057  56.114   0.305    6.71   12       41.9       27.2
   73   2   4   2 28.395  56.79    0.309    6.53   12       20.8        6.5
   74   4   2   2 28.395  56.79    0.309    6.53   12       18.4        5.1
   75   1   2   3 28.896  57.792   0.314    6.28   12       67.8       66.5
   76   2   1   3 28.896  57.792   0.314    6.28   12       67.5       65.9
   77   1   6   1 28.898  57.796   0.314    6.28   12       37.4       20.2
   78   6   1   1 28.898  57.796   0.314    6.28   12       32.1       14.9
   79   4   4   0 29.064  58.128   0.315    6.2     6       92.4       60.9
   80   1   5   2 29.394  58.788   0.319    6.04   12        5.6        0.4
   81   5   1   2 29.394  58.788   0.319    6.04   12       18.7        4.8
   82   3   5   0 29.395  58.789   0.319    6.04    6       47.2       15.5
   83   5   3   0 29.395  58.789   0.319    6.04    6       32.4        7.3
   84   7   0   0 29.395  58.789   0.319    6.04    6        1.9        0.0
   85   3   0   3 29.557  59.114   0.32     5.97   12       16.5        3.8
   86   2   6   0 30.373  60.746   0.328    5.62    6       17.0        1.9
   87   6   2   0 30.373  60.746   0.328    5.62    6       17.9        2.1
   88   2   2   3 30.532  61.064   0.33     5.55   12        9.2        1.1
   89   4   4   1 30.534  61.068   0.33     5.55   12        9.5        1.2
   90   1   3   3 30.853  61.706   0.333    5.42   12       31.3       12.2
   91   3   1   3 30.853  61.706   0.333    5.42   12       42.8       22.9
   92   3   5   1 30.855  61.71    0.333    5.42   12       65.1       52.9
   93   5   3   1 30.855  61.71    0.333    5.42   12       51.0       32.5
   94   7   0   1 30.855  61.71    0.333    5.42   12       55.9       39.1
   95   6   0   2 31.014  62.028   0.334    5.36   12       71.3       62.8
   96   3   4   2 31.332  62.664   0.338    5.24   12       22.5        6.1
   97   4   3   2 31.332  62.664   0.338    5.24   12       15.4        2.8
   98   4   0   3 31.805  63.609   0.342    5.07   12       76.8       68.9
   99   2   6   1 31.806  63.612   0.342    5.07   12       50.8       30.2
  100   6   2   1 31.806  63.612   0.342    5.07   12       50.4       29.7
  101   2   5   2 31.963  63.925   0.344    5.02   12       25.1        7.3
  102   5   2   2 31.963  63.925   0.344    5.02   12       37.4       16.1
  103   1   7   0 31.963  63.927   0.344    5.02    6       60.9       21.5
  104   7   1   0 31.963  63.927   0.344    5.02    6       86.2       43.0
  105   2   3   3 32.741  65.481   0.351    4.76   12       43.8       21.0
  106   3   2   3 32.741  65.481   0.351    4.76   12       40.5       18.0
  107   1   6   2 33.204  66.408   0.355    4.62   12       17.0        3.1
  108   6   1   2 33.204  66.408   0.355    4.62   12       16.2        2.8
  109   4   5   0 33.205  66.41    0.355    4.62    6       11.5        0.7
  110   5   4   0 33.205  66.41    0.355    4.62    6       12.6        0.8
  111   1   4   3 33.357  66.714   0.357    4.58   12       20.5        4.4
  112   4   1   3 33.357  66.714   0.357    4.58   12        8.6        0.8
  113   1   7   1 33.358  66.717   0.357    4.58   12        9.4        0.9
  114   7   1   1 33.358  66.717   0.357    4.58   12        2.0        0.0
  115   3   6   0 33.817  67.634   0.361    4.45    6       19.3        1.9
  116   6   3   0 33.817  67.634   0.361    4.45    6       25.8        3.4
  117   8   0   0 34.121  68.242   0.364    4.37    6       35.8        6.5
  118   5   0   3 34.573  69.145   0.368    4.25   12       31.9       10.0
  119   4   5   1 34.574  69.149   0.368    4.25   12       26.0        6.6
  120   5   4   1 34.574  69.149   0.368    4.25   12       16.9        2.8
  121   4   4   2 34.724  69.449   0.37     4.21   12       89.5       77.7
  122   3   5   2 35.025  70.049   0.373    4.14   12       31.7        9.6
  123   5   3   2 35.025  70.049   0.373    4.14   12       13.5        1.8
  124   7   0   2 35.025  70.049   0.373    4.14   12       40.7       15.8
  125   2   7   0 35.025  70.051   0.373    4.14    6       42.0        8.4
  126   7   2   0 35.025  70.051   0.373    4.14    6       21.6        2.2
  127   3   3   3 35.173  70.347   0.374    4.1    12        4.0        0.2
  128   3   6   1 35.175  70.35    0.374    4.1    12       13.1        1.6
  129   6   3   1 35.175  70.35    0.374    4.1    12       12.6        1.5
  130   2   4   3 35.472  70.944   0.377    4.04   12       17.4        2.8
  131   4   2   3 35.472  70.944   0.377    4.04   12       24.0        5.4
  132   8   0   1 35.473  70.947   0.377    4.03   12      110.4      113.3
  133   2   6   2 35.919  71.837   0.381    3.94   12       17.2        2.7
  134   6   2   2 35.919  71.837   0.381    3.94   12       13.5        1.7
  135   1   5   3 36.361  72.723   0.385    3.84   12       34.3       10.4
  136   5   1   3 36.361  72.723   0.385    3.84   12       37.6       12.5
  137   2   7   1 36.363  72.726   0.385    3.84   12       37.0       12.1
  138   7   2   1 36.363  72.726   0.385    3.84   12       27.4        6.6
  139   0   0   4 36.507  73.015   0.386    3.82    2      124.7       22.8
  140   1   0   4 36.801  73.603   0.389    3.76   12       18.4        2.9
  141   1   8   0 36.804  73.609   0.389    3.76    6        0.4        0.0
  142   8   1   0 36.804  73.609   0.389    3.76    6        9.3        0.4
  143   1   1   4 37.387  74.774   0.394    3.65   12       54.7       25.2
  144   1   7   2 37.389  74.778   0.394    3.65   12       54.7       25.1
  145   7   1   2 37.389  74.778   0.394    3.65   12       70.7       42.1
  146   5   5   0 37.39   74.78    0.394    3.65    6       28.2        3.3
  147   2   0   4 37.679  75.357   0.397    3.6    12       26.4        5.8
  148   4   6   0 37.682  75.363   0.397    3.6     6       36.2        5.4
  149   6   4   0 37.682  75.363   0.397    3.6     6       38.4        6.1
  150   6   0   3 37.825  75.651   0.398    3.57   12        5.1        0.2
  151   3   4   3 38.116  76.231   0.401    3.53   12       54.3       24.0
  152   4   3   3 38.116  76.231   0.401    3.53   12       41.3       13.8
  153   1   8   1 38.117  76.234   0.401    3.52   12       34.2        9.5
  154   8   1   1 38.117  76.234   0.401    3.52   12       58.3       27.6
  155   1   2   4 38.549  77.097   0.405    3.46   12       17.2        2.4
  156   2   1   4 38.549  77.097   0.405    3.46   12        9.4        0.7
  157   4   5   2 38.551  77.102   0.405    3.46   12       14.5        1.7
  158   5   4   2 38.551  77.102   0.405    3.46   12        7.1        0.4
  159   3   7   0 38.552  77.103   0.405    3.46    6       31.6        4.0
  160   7   3   0 38.552  77.103   0.405    3.46    6       16.8        1.1
  161   2   5   3 38.694  77.389   0.406    3.43   12       27.1        5.8
  162   5   2   3 38.694  77.389   0.406    3.43   12       16.5        2.2
  163   5   5   1 38.696  77.392   0.406    3.43   12        6.7        0.4
  164   4   6   1 38.984  77.968   0.408    3.39   12       19.1        2.8
  165   6   4   1 38.984  77.968   0.408    3.39   12       18.8        2.8
  166   3   0   4 39.125  78.251   0.41     3.37   12       33.9        9.0
  167   3   6   2 39.128  78.255   0.41     3.37   12       57.7       25.8
  168   6   3   2 39.128  78.255   0.41     3.37   12       62.9       30.7
  169   9   0   0 39.128  78.257   0.41     3.37    6       59.6       13.8
  170   8   0   2 39.415  78.83    0.412    3.33   12       37.8       11.0
  171   1   6   3 39.844  79.688   0.416    3.27   12       29.0        6.3
  172   6   1   3 39.844  79.688   0.416    3.27   12       17.4        2.3
  173   3   7   1 39.846  79.691   0.416    3.27   12       35.0        9.3
  174   7   3   1 39.846  79.691   0.416    3.27   12       29.0        6.4
  175   2   2   4 39.986  79.972   0.417    3.26   12       38.5       11.1
  176   2   8   0 39.989  79.978   0.417    3.26    6       39.1        5.7
  177   8   2   0 39.989  79.978   0.417    3.26    6       42.4        6.8
  178   1   3   4 40.272  80.544   0.42     3.22   12        8.9        0.6
  179   3   1   4 40.272  80.544   0.42     3.22   12        5.7        0.2
  180   2   7   2 40.274  80.548   0.42     3.22   12       27.8        5.7
  181   7   2   2 40.274  80.548   0.42     3.22   12       10.5        0.8
  182   9   0   1 40.417  80.834   0.421    3.2    12       13.0        1.2
  183   4   0   4 41.126  82.253   0.427    3.12   12       47.5       16.2
  184   4   4   3 41.27   82.54    0.428    3.11   12        2.1        0.0
  185   2   8   1 41.271  82.543   0.428    3.11   12       44.5       14.2
  186   8   2   1 41.271  82.543   0.428    3.11   12       34.5        8.5
  187   3   5   3 41.554  83.108   0.431    3.08   12       48.1       16.4
  188   5   3   3 41.554  83.108   0.431    3.08   12       40.6       11.7
  189   7   0   3 41.554  83.108   0.431    3.08   12       52.9       19.8
  190   2   3   4 41.978  83.956   0.434    3.04   12       52.8       19.6
  191   3   2   4 41.978  83.956   0.434    3.04   12       57.7       23.3
  192   1   8   2 41.98   83.96    0.434    3.04   12       17.2        2.1
  193   8   1   2 41.98   83.96    0.434    3.04   12       15.6        1.7
  194   1   9   0 41.981  83.961   0.434    3.04    6        2.8        0.0
  195   5   6   0 41.981  83.961   0.434    3.04    6       34.8        4.2
  196   6   5   0 41.981  83.961   0.434    3.04    6       22.1        1.7
  197   9   1   0 41.981  83.961   0.434    3.04    6        3.6        0.0
  198   2   6   3 42.404  84.807   0.438    3.0    12       61.7       26.3
  199   6   2   3 42.404  84.807   0.438    3.0    12       63.7       28.1
  200   1   4   4 42.544  85.087   0.439    2.99   12       11.7        0.9
  201   4   1   4 42.544  85.087   0.439    2.99   12       15.0        1.6
  202   5   5   2 42.546  85.092   0.439    2.99   12       11.3        0.9
  203   4   7   0 42.547  85.093   0.439    2.99    6       44.7        6.9
  204   7   4   0 42.547  85.093   0.439    2.99    6       55.4       10.6
  205   4   6   2 42.829  85.657   0.441    2.97   12       43.8       13.1
  206   6   4   2 42.829  85.657   0.441    2.97   12       46.0       14.5
  207   1   9   1 43.253  86.505   0.445    2.94   12       14.5        1.4
  208   5   6   1 43.253  86.505   0.445    2.94   12       27.7        5.2
  209   6   5   1 43.253  86.505   0.445    2.94   12       20.8        2.9
  210   9   1   1 43.253  86.505   0.445    2.94   12        9.9        0.7
  211   5   0   4 43.673  87.346   0.448    2.91   12       28.3        5.3
  212   3   7   2 43.675  87.35    0.448    2.91   12       13.4        1.2
  213   7   3   2 43.675  87.35    0.448    2.91   12       15.4        1.6
  214   3   8   0 43.676  87.352   0.448    2.91    6       25.3        2.1
  215   8   3   0 43.676  87.352   0.448    2.91    6       20.2        1.4
  216   1   7   3 43.815  87.631   0.449    2.9    12        9.1        0.6
  217   7   1   3 43.815  87.631   0.449    2.9    12        9.2        0.6
  218   4   7   1 43.817  87.634   0.449    2.9    12       11.4        0.9
  219   7   4   1 43.817  87.634   0.449    2.9    12       11.0        0.8
  220   3   3   4 44.237  88.474   0.453    2.87   12       24.3        3.9
  221   9   0   2 44.239  88.478   0.453    2.87   12       33.6        7.5
  222   2   4   4 44.519  89.037   0.455    2.85   12       28.0        5.1
  223   4   2   4 44.519  89.037   0.455    2.85   12       33.4        7.3
  224  10   0   0 44.521  89.043   0.455    2.85    6        5.4        0.1
  225   4   5   3 44.942  89.885   0.459    2.83   12       13.4        1.2
  226   5   4   3 44.942  89.885   0.459    2.83   12       14.2        1.3
  227   3   8   1 44.944  89.888   0.459    2.83   12       31.9        6.6
  228   8   3   1 44.944  89.888   0.459    2.83   12       24.7        4.0


  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   4.021   8.041 10.98553       17.5      1.9      1.9     5.6
    2   1   1   0   6.976  13.951  6.3425       466.2     50.1     50.6     5.6
    3   2   0   0   8.061  16.123  5.49277       15.9      1.7      1.7     5.6
    4   1   0   1   9.464  18.928  4.68452      708.9     76.2     76.7     5.6
    5   1   2   0  10.691  21.382  4.15214       87.5      9.4      9.4     5.6
    6   2   0   1  11.795  23.591  3.76815       11.9      1.3      1.3     5.6
    7   3   0   0  12.143  24.286  3.66184      479.5     51.5     51.7     5.6
    8   2   1   1  13.755  27.51   3.23955      930.1    100.0    100.0     5.6
    9   3   1   0  14.644  29.288  3.04684       10.6      1.1      1.1     5.6
   10   3   0   1  14.929  29.858  2.98995       58.3      6.3      6.3     5.6
   11   4   0   0  16.288  32.577  2.74638      294.2     31.6     31.5     5.6
   12   3   1   1  17.057  34.113  2.62609      206.6     22.2     22.1     5.7
   13   0   0   2  17.305  34.611  2.5895       268.9     28.9     28.7     5.7
   14   1   0   2  17.795  35.59   2.52042       92.4      9.9      9.9     5.7
   15   4   0   1  18.51   37.02   2.42634      285.3     30.7     30.4     5.7
   16   4   1   0  18.743  37.485  2.39724       45.0      4.8      4.8     5.7
   17   2   3   1  19.871  39.742  2.26617      111.0     11.9     11.8     5.7
   18   5   0   0  20.523  41.047  2.19711       16.8      1.8      1.8     5.7
   19   4   1   1  20.737  41.473  2.17549       99.7     10.7     10.6     5.7
   20   3   3   0  21.367  42.734  2.11417      293.4     31.5     31.1     5.7
   21   5   0   1  22.385  44.77   2.02262       58.8      6.3      6.2     5.7
   22   2   2   2  22.584  45.168  2.00576       10.9      1.2      1.1     5.7
   23   3   1   2  22.978  45.957  1.97314       16.9      1.8      1.8     5.7
   24   4   0   2  24.132  48.264  1.88407       94.4     10.1      9.9     5.7
   25   2   3   2  25.245  50.491  1.80607      153.4     16.5     16.1     5.8
   26   5   2   0  25.969  51.938  1.75909      152.8     16.4     16.0     5.8
   27   3   4   1  26.853  53.705  1.7053        64.3      6.9      6.7     5.8
   28   5   0   2  27.373  54.746  1.67533       12.4      1.3      1.3     5.8
   29   5   2   1  27.546  55.091  1.66563       53.0      5.7      5.5     5.8
   30   2   0   3  27.886  55.772  1.64691       32.6      3.5      3.4     5.8
   31   3   3   2  28.057  56.114  1.63767       27.2      2.9      2.8     5.8
   32   2   4   2  28.395  56.79   1.61977       11.6      1.2      1.2     5.8
   33   1   2   3  28.896  57.792  1.59405      167.5     18.0     17.4     5.8
   34   4   4   0  29.064  58.128  1.58563       60.9      6.5      6.3     5.8
   35   5   3   0  29.395  58.789  1.56936       27.7      3.0      2.9     5.8
   36   7   0   1  30.855  61.71   1.50192      159.6     17.2     16.5     5.8
   37   6   0   2  31.014  62.028  1.49498       62.8      6.7      6.5     5.8
   38   4   0   3  31.805  63.609  1.46157      128.9     13.9     13.3     5.9
   39   7   1   0  31.963  63.927  1.45507       87.9      9.4      9.1     5.9
   40   2   3   3  32.741  65.481  1.42424       39.0      4.2      4.0     5.9
   41   5   0   3  34.573  69.145  1.35744       19.3      2.1      2.0     5.9
   42   4   4   2  34.724  69.449  1.35225       77.7      8.4      7.9     5.9
   43   7   0   2  35.025  70.049  1.34212       37.7      4.1      3.9     5.9
   44   8   0   1  35.473  70.947  1.32733      121.5     13.1     12.4     5.9
   45   2   7   1  36.363  72.726  1.29918       41.7      4.5      4.2     6.0
   46   0   0   4  36.507  73.015  1.29475       22.8      2.5      2.3     6.0
   47   7   1   2  37.389  74.778  1.26852       95.7     10.3      9.7     6.0
   48   6   4   0  37.682  75.363  1.26013       17.3      1.9      1.7     6.0
   49   8   1   1  38.117  76.234  1.24788       74.9      8.1      7.6     6.0
   50   3   7   0  38.552  77.103  1.23597       10.3      1.1      1.0     6.0
   51   9   0   0  39.128  78.257  1.22061       79.3      8.5      8.0     6.0
   52   8   0   2  39.415  78.83   1.21317       11.0      1.2      1.1     6.0
   53   7   3   1  39.846  79.691  1.20221       24.2      2.6      2.4     6.0
   54   2   2   4  39.986  79.972  1.19869       23.6      2.5      2.4     6.0
   55   4   0   4  41.126  82.253  1.17113       16.2      1.7      1.6     6.1
   56   2   8   1  41.271  82.543  1.16775       22.7      2.4      2.3     6.1
   57   7   0   3  41.554  83.108  1.16124       47.9      5.2      4.8     6.1
   58   3   2   4  41.978  83.956  1.15166       52.7      5.7      5.2     6.1
   59   6   2   3  42.404  84.807  1.14226       54.4      5.8      5.4     6.1
   60   7   4   0  42.547  85.093  1.13915       19.9      2.1      2.0     6.1
   61   6   4   2  42.829  85.657  1.13309       27.6      3.0      2.7     6.1
   62   6   5   1  43.253  86.505  1.12414       10.2      1.1      1.0     6.1
   63   5   0   4  43.673  87.346  1.11547       11.6      1.3      1.1     6.2
   64   9   0   2  44.239  88.478  1.1041        11.4      1.2      1.1     6.2
   65   4   2   4  44.519  89.037  1.09861       12.6      1.4      1.2     6.2
   66   8   3   1  44.944  89.888  1.09041       13.1      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)