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       ***
                  ***********************
SANIDINE

14, t-sanidine, analogue

KGaSi(3)O(8)


Monoclinic  C 2/m  Z = 4

C2/m

15 .10 .25

Ref.Str.:

         A.R. Kotelnikov, N.I. Suk, Z.A. Kotelnikova, G.M. Akhmedzhanova,

         N.A. Drozhzhina (2025) * Petrology, 33(5),  437-453,

         DOI:10.1134/S0869591125700183

         L: $K0.998 Ga1.001 Si3.00 O8.0$

         R: The coordinates of atoms are from SANIDINE analogue [8].

         Sample 7540. N.A.D.

                   Initial data from BDM-file 

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

             a =   8.6535   alpha =   90.0 
             b =  13.0805   beta  =  116.08
             c =   7.2216   gamma =   90.0 

    Unit cell volume (cub. angs.) =   734.18

    Molar volume ( cub.cm/mol.) =   110.56

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

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

   1 0.2864  0.0     0.1391   0.0    K     = 1.00
   2 0.0079  0.1863  0.2217   0.0    Si    = 0.75, Ga    = 0.25
   3 0.7098  0.118   0.3436   0.0    Si    = 0.75, Ga    = 0.25
   4 0.0     0.1454  0.0      0.0    O     = 1.00
   5 0.6383  0.0     0.2838   0.0    O     = 1.00
   6 0.8262  0.1478  0.2231   0.0    O     = 1.00
   7 0.0343  0.3115  0.2583   0.0    O     = 1.00
   8 0.1792  0.126   0.4047   0.0    O     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.2864     0.0        0.1391
     2       2     0.0079     0.1863     0.2217
     3       3     0.7098     0.118      0.3436
     4       4     0.0        0.1454     0.0   
     5       5     0.6383     0.0        0.2838
     6       6     0.8262     0.1478     0.2231
     7       7     0.0343     0.3115     0.2583
     8       8     0.1792     0.126      0.4047
     9       1     0.7136     0.0        0.8609
    10       2     0.9921     0.8137     0.7783
    11       3     0.2902     0.882      0.6564
    12       4     0.0        0.8546     0.0   
    13       5     0.3617     0.0        0.7162
    14       6     0.1738     0.8522     0.7769
    15       7     0.9657     0.6885     0.7417
    16       8     0.8208     0.874      0.5954
    17       2     0.0079     0.8137     0.2217
    18       3     0.7098     0.882      0.3436
    19       6     0.8262     0.8522     0.2231
    20       7     0.0343     0.6885     0.2583
    21       8     0.1792     0.874      0.4047
    22       2     0.9921     0.1863     0.7783
    23       3     0.2902     0.118      0.6564
    24       6     0.1738     0.1478     0.7769
    25       7     0.9657     0.3115     0.7417
    26       8     0.8208     0.126      0.5954
    27       1     0.7864     0.5        0.1391
    28       2     0.5079     0.3137     0.2217
    29       3     0.2098     0.382      0.3436
    30       4     0.5        0.3546     0.0   
    31       5     0.1383     0.5        0.2838
    32       6     0.3262     0.3522     0.2231
    33       7     0.5343     0.1885     0.2583
    34       8     0.6792     0.374      0.4047
    35       1     0.2136     0.5        0.8609
    36       2     0.4921     0.6863     0.7783
    37       3     0.7902     0.618      0.6564
    38       4     0.5        0.6454     0.0   
    39       5     0.8617     0.5        0.7162
    40       6     0.6738     0.6478     0.7769
    41       7     0.4657     0.8115     0.7417
    42       8     0.3208     0.626      0.5954
    43       2     0.5079     0.6863     0.2217
    44       3     0.2098     0.618      0.3436
    45       6     0.3262     0.6478     0.2231
    46       7     0.5343     0.8115     0.2583
    47       8     0.6792     0.626      0.4047
    48       2     0.4921     0.3137     0.7783
    49       3     0.7902     0.382      0.6564
    50       6     0.6738     0.3522     0.7769
    51       7     0.4657     0.1885     0.7417
    52       8     0.3208     0.374      0.5954


X-ray density (g/cm cub.)   =      2.9 

MU (1/cm) =     167.728    Mass attenuation coefficient (cm**2/g) =     57.762

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

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

    1    K                   3.228        9
                                                 2.929        4
                                                 2.7505       5
                                                 2.9696       8
                                                 2.929        4
                                                 3.0472       6
                                                 2.9696       8
                                                 3.0472       6
                                                 3.1301       7
                                                 3.1301       7
    2   Si   ,Ga             2.376        4
                                                 1.6603       4
                                                 1.6555       6
                                                 1.6593       7
                                                 1.6861       8
    3   Si   ,Ga             2.376        4
                                                 1.6481       5
                                                 1.6411       6
                                                 1.6442       8
                                                 1.6476       7
    4    O                   3.264        6
                                                 2.644        6
                                                 2.7932       7
                                                 2.6502       8
                                                 2.644        6
                                                 2.7932       7
                                                 2.6502       8
    5    O                   3.264        6
                                                 2.6829       6
                                                 2.6734       8
                                                 2.6829       6
                                                 2.6734       8
                                                 2.6032       7
                                                 2.6032       7
    6    O                   3.264        6
                                                 2.644        4
                                                 2.6829       5
                                                 2.7374       7
                                                 2.7584       8
                                                 2.7237       8
                                                 2.7006       7
    7    O                   3.264        6
                                                 2.7932       4
                                                 2.7374       6
                                                 2.7229       8
                                                 2.6032       5
                                                 2.7006       6
                                                 2.7267       8
    8    O                   3.264        6
                                                 2.6502       4
                                                 2.7584       6
                                                 2.7229       7
                                                 2.6734       5
                                                 2.7237       6
                                                 2.7267       7

  X-ray diffraction powder data (II),  X-Ray W.L. =   1.78892(angs.):

  No   H   K   L   Theta 2*Theta    S       LPG   MF        F          I int.
                    ( degree )                                         *100

    1   1   1   0  7.693  15.386   0.075  108.65    4       23.7       45.5
    2   0   2   0  7.861  15.721   0.076  103.98    2       51.2      101.3
    3   0   0   1  7.927  15.853   0.077  102.22    2       25.5       24.7
    4   1   1  -1  8.72   17.439   0.085   84.09    4       38.4       92.1
    5   0   2   1 11.199  22.398   0.109   50.13    4        7.0        1.8
    6   2   0  -1 12.12   24.24    0.117   42.49    2      166.6      437.7
    7   1   1   1 13.038  26.076   0.126   36.44    4       79.8      172.3
    8   2   0   0 13.307  26.614   0.129   34.9     2       35.6       16.5
    9   1   3   0 13.605  27.209   0.131   33.3     4      143.9      511.8
   10   1   3  -1 14.226  28.452   0.137   30.29    4       62.3       87.1
   11   2   2  -1 14.512  29.023   0.14    29.03    4       51.7       57.6
   12   1   1  -2 14.896  29.791   0.144   27.45    4      117.4      280.8
   13   2   2   0 15.529  31.059   0.15    25.1     4      181.5      613.7
   14   2   0  -2 15.7    31.4     0.151   24.52    2      200.5      365.6
   15   0   4   0 15.874  31.748   0.153   23.94    2      148.7      196.4
   16   0   0   2 16.01   32.02    0.154   23.51    2      243.9      518.8
   17   1   3   1 17.287  34.574   0.166   19.9     4      158.5      371.0
   18   2   2  -2 17.65   35.299   0.169   19.02    4       71.5       72.1
   19   0   4   1 17.838  35.675   0.171   18.58    4      105.8      154.4
   20   0   2   2 17.93   35.86    0.172   18.37    4       78.9       84.9
   21   2   0   1 18.426  36.852   0.177   17.31    2       21.9        3.1
   22   3   1  -1 18.533  37.065   0.178   17.09    4       31.6       12.7
   23   1   3  -2 18.765  37.531   0.18    16.62    4       98.0      118.5
   24   3   1  -2 19.932  39.863   0.191   14.55    4      123.5      164.5
   25   2   2   1 20.145  40.29    0.193   14.21    4       39.6       16.5
   26   2   4  -1 20.171  40.341   0.193   14.17    4      153.2      246.8
   27   1   1   2 20.435  40.87    0.195   13.76    4       90.8       84.1
   28   3   1   0 20.607  41.214   0.197   13.5     4       93.6       87.7
   29   2   4   0 20.946  41.891   0.2     13.02    4       68.1       44.8
   30   1   5   0 21.147  42.293   0.202   12.75    4       34.7       11.4
   31   1   5  -1 21.574  43.148   0.206   12.19    4       89.2       71.9
   32   3   3  -1 21.843  43.686   0.208   11.85    4       88.8       69.3
   33   2   0  -3 22.006  44.011   0.209   11.66    2       53.2       12.2
   34   1   1  -3 22.562  45.123   0.214   11.02    4       42.9       15.0
   35   2   4  -2 22.629  45.258   0.215   10.94    4        5.5        0.3
   36   0   4   2 22.857  45.715   0.217   10.7     4       12.7        1.3
   37   3   3  -2 23.075  46.151   0.219   10.47    4        1.0        0.0
   38   2   2  -3 23.508  47.016   0.223   10.04    4       37.0       10.2
   39   1   3   2 23.524  47.048   0.223   10.02    4       20.2        3.0
   40   3   3   0 23.678  47.357   0.224    9.88    4        8.7        0.6
   41   1   5   1 23.821  47.642   0.226    9.74    4       69.2       34.7
   42   0   6   0 24.223  48.446   0.229    9.38    2      195.9      133.5
   43   3   1  -3 24.307  48.613   0.23     9.31    4       23.2        3.7
   44   0   0   3 24.438  48.876   0.231    9.19    2       32.2        3.5
   45   2   4   1 24.708  49.416   0.234    8.97    4       85.1       48.2
   46   4   0  -1 24.737  49.474   0.234    8.94    2       53.3        9.4
   47   4   0  -2 24.83   49.659   0.235    8.87    2       76.5       19.2
   48   1   5  -2 24.977  49.954   0.236    8.75    4       45.8       13.6
   49   1   3  -3 25.447  50.893   0.24     8.39    4       48.3       14.5
   50   3   1   1 25.457  50.914   0.24     8.38    4       24.9        3.8
   51   2   0   2 25.465  50.931   0.24     8.37    2       59.8       11.1
   52   0   6   1 25.648  51.296   0.242    8.24    4       71.9       31.6
   53   0   2   3 25.832  51.663   0.244    8.1     4        8.7        0.5
   54   4   2  -1 26.119  52.238   0.246    7.9     4       21.8        2.8
   55   4   2  -2 26.208  52.416   0.247    7.84    4      124.9       90.7
   56   2   2   2 26.82   53.64    0.252    7.44    4      122.9       83.3
   57   3   3  -3 27.052  54.103   0.254    7.29    4       53.2       15.3
   58   4   0   0 27.409  54.818   0.257    7.08    2      183.3       88.3
   59   2   6  -1 27.445  54.889   0.258    7.06    4       30.2        4.8
   60   3   5  -1 27.503  55.005   0.258    7.03    4       51.1       13.6
   61   2   4  -3 27.64   55.28    0.259    6.95    4       15.3        1.2
   62   4   0  -3 27.667  55.333   0.26     6.93    2      109.9       31.1
   63   2   6   0 28.063  56.126   0.263    6.71    4       67.0       22.4
   64   3   3   1 28.122  56.244   0.263    6.68    4       56.1       15.6
   65   3   5  -2 28.551  57.103   0.267    6.45    4       24.8        2.9
   66   4   2   0 28.7    57.4     0.268    6.38    4       67.9       21.8
   67   1   1   3 28.722  57.445   0.269    6.37    4       88.9       37.3
   68   1   5   2 28.938  57.876   0.27     6.26    4       51.5       12.3
   69   4   2  -3 28.95   57.9     0.271    6.25    4       55.5       14.3
   70   3   5   0 29.071  58.143   0.272    6.2     4       72.7       24.3
   71   2   6  -2 29.438  58.877   0.275    6.02    4       82.7       30.6
   72   1   7   0 29.492  58.985   0.275    6.0     4        5.3        0.1
   73   0   6   2 29.628  59.257   0.276    5.94    4      117.3       60.6
   74   2   0  -4 29.709  59.417   0.277    5.9     2      266.5      155.5
   75   0   4   3 29.733  59.466   0.277    5.89    4      129.1       72.9
   76   1   7  -1 29.83   59.659   0.278    5.85    4       22.9        2.3
   77   4   4  -1 29.995  59.99    0.279    5.78    4      109.4       51.3
   78   4   4  -2 30.076  60.152   0.28     5.74    4       66.8       19.0
   79   1   5  -3 30.62   61.241   0.285    5.52    4        2.9        0.0
   80   2   4   2 30.637  61.273   0.285    5.51    4       89.7       32.9
   81   3   1  -4 30.702  61.404   0.285    5.48    4       16.8        1.1
   82   2   2  -4 30.938  61.877   0.287    5.39    4       10.2        0.4
   83   1   1  -4 31.072  62.144   0.289    5.34    4       37.5        5.6
   84   2   6   1 31.193  62.386   0.29     5.29    4        3.6        0.1
   85   1   3   3 31.2    62.4     0.29     5.29    4       60.8       14.5
   86   5   1  -2 31.455  62.909   0.292    5.2     4       57.6       12.8
   87   1   7   1 31.65   63.3     0.293    5.13    4       34.1        4.4
   88   3   5  -3 32.054  64.107   0.297    4.99    4      121.7       54.8
   89   3   1   2 32.182  64.365   0.298    4.94    4       28.3        2.9
   90   5   1  -1 32.268  64.536   0.298    4.92    4       28.7        3.0
   91   4   4   0 32.376  64.751   0.299    4.88    4       37.5        5.1
   92   4   0   1 32.377  64.754   0.299    4.88    2       16.9        0.5
   93   4   4  -3 32.609  65.218   0.301    4.81    4        5.6        0.1
   94   1   7  -2 32.616  65.232   0.301    4.8     4       91.3       29.7
   95   4   0  -4 32.765  65.531   0.303    4.76    2       43.6        3.4
   96   3   5   1 33.022  66.044   0.305    4.68    4      124.5       53.9
   97   5   1  -3 33.061  66.122   0.305    4.67    4       66.4       15.3
   98   3   3  -4 33.092  66.183   0.305    4.66    4       51.1        9.0
   99   0   8   0 33.165  66.33    0.306    4.64    2       75.6        9.8
  100   1   3  -4 33.447  66.894   0.308    4.55    4       46.0        7.2
  101   0   0   4 33.478  66.956   0.308    4.54    2       23.4        0.9
  102   4   2   1 33.551  67.102   0.309    4.52    4       26.0        2.3
  103   2   0   3 33.701  67.402   0.31     4.48    2       80.0       10.6
  104   2   6  -3 33.755  67.51    0.311    4.47    4       18.0        1.1
  105   5   3  -2 33.815  67.63    0.311    4.45    4        8.7        0.3
  106   4   2  -4 33.932  67.865   0.312    4.42    4      111.1       40.5
  107   0   8   1 34.344  68.688   0.315    4.31    4       52.8        8.9
  108   2   4  -4 34.476  68.952   0.316    4.27    4       47.6        7.2
  109   3   3   2 34.517  69.033   0.317    4.26    4       24.0        1.8
  110   5   3  -1 34.599  69.198   0.317    4.24    4       40.2        5.1
  111   0   2   4 34.633  69.266   0.318    4.23    4      114.6       41.3
  112   3   7  -1 34.785  69.571   0.319    4.2     4       18.1        1.0
  113   2   2   3 34.852  69.705   0.319    4.18    4       59.6       11.0
  114   5   3  -3 35.367  70.733   0.324    4.06    4      146.6       64.7
  115   5   1   0 35.413  70.827   0.324    4.05    4       28.4        2.4
  116   0   6   3 35.638  71.276   0.326    4.0     4       80.6       19.3
  117   3   7  -2 35.708  71.417   0.326    3.98    4       27.4        2.2
  118   1   5   3 35.86   71.72    0.327    3.95    4       54.1        8.6
  119   2   8  -1 35.871  71.741   0.328    3.95    4       40.9        4.9
  120   4   6  -1 35.876  71.753   0.328    3.95    4      131.4       50.5
  121   4   6  -2 35.951  71.901   0.328    3.93    4       15.6        0.7
  122   1   7   2 36.052  72.103   0.329    3.91    4       17.6        0.9
  123   3   7   0 36.17   72.341   0.33     3.88    4       12.5        0.5
  124   2   8   0 36.406  72.811   0.332    3.84    4      244.1      169.6
  125   2   6   2 36.464  72.927   0.332    3.82    4       36.8        3.9
  126   5   1  -4 36.927  73.853   0.336    3.73    4       91.3       23.1
  127   4   4   1 36.963  73.927   0.336    3.73    4       46.7        6.0
  128   4   4  -4 37.329  74.658   0.339    3.66    4       20.4        1.1
  129   1   7  -3 37.563  75.126   0.341    3.62    4       79.2       16.8
  130   2   8  -2 37.612  75.225   0.341    3.61    4       64.7       11.2
  131   3   5  -4 37.637  75.275   0.341    3.61    4        3.1        0.0
  132   5   3   0 37.654  75.309   0.341    3.6     4       95.2       24.2
  133   0   8   2 37.781  75.562   0.342    3.58    4       64.8       11.2
  134   1   1   4 37.94   75.88    0.344    3.55    4      107.5       30.5
  135   1   5  -4 37.974  75.948   0.344    3.55    4       62.7       10.4
  136   0   4   4 38.003  76.006   0.344    3.54    4       20.3        1.1
  137   4   6   0 38.071  76.143   0.345    3.53    4       76.7       15.4
  138   2   4   3 38.215  76.43    0.346    3.51    4      155.6       63.1
  139   4   6  -3 38.289  76.577   0.346    3.5     4       78.2       15.9
  140   5   5  -2 38.323  76.647   0.347    3.49    4      102.0       26.9
  141   6   0  -2 38.375  76.75    0.347    3.48    2      211.6       57.9
  142   2   0  -5 38.578  77.156   0.349    3.45    2       60.6        4.7
  143   3   1  -5 38.644  77.288   0.349    3.44    4       44.4        5.0
  144   1   9   0 38.763  77.526   0.35     3.42    4       70.3       12.6
  145   3   7  -3 38.873  77.746   0.351    3.41    4       34.9        3.1
  146   3   5   2 38.992  77.983   0.352    3.39    4       67.5       11.5
  147   6   0  -3 39.042  78.083   0.352    3.38    2       50.2        3.2
  148   1   9  -1 39.06   78.119   0.352    3.38    4       36.2        3.3
  149   5   5  -1 39.071  78.141   0.352    3.38    4        6.4        0.1
  150   5   3  -4 39.135  78.271   0.353    3.37    4       23.3        1.4
  151   2   8   1 39.183  78.366   0.353    3.36    4        8.1        0.2
  152   4   0   2 39.21   78.419   0.353    3.36    2      222.6       61.8
  153   6   2  -2 39.471  78.943   0.355    3.32    4       14.4        0.5
  154   2   2  -5 39.673  79.346   0.357    3.3     4       14.2        0.5
  155   4   0  -5 39.712  79.424   0.357    3.29    2      138.4       23.4
  156   3   7   1 39.769  79.538   0.358    3.28    4       21.1        1.1
  157   5   5  -3 39.805  79.611   0.358    3.28    4       76.4       14.2
  158   6   0  -1 39.936  79.873   0.359    3.26    2       88.1        9.4
  159   2   6  -4 40.045  80.089   0.36     3.25    4       97.7       23.0
  160   1   3   4 40.131  80.262   0.36     3.24    4       73.9       13.1
  161   6   2  -3 40.133  80.265   0.36     3.24    4       61.4        9.0
  162   4   2   2 40.3    80.599   0.362    3.22    4       33.9        2.7
  163   3   1   3 40.433  80.867   0.363    3.2     4       26.6        1.7
  164   1   1  -5 40.604  81.208   0.364    3.18    4       73.8       12.8
  165   5   1   1 40.662  81.325   0.364    3.18    4        0.1        0.0
  166   1   9   1 40.685  81.37    0.364    3.17    4       11.3        0.3
  167   4   2  -5 40.799  81.597   0.365    3.16    4       91.0       19.4
  168   3   3  -5 40.825  81.649   0.365    3.16    4       14.6        0.5
  169   6   2  -1 41.022  82.043   0.367    3.14    4       87.2       17.7
  170   2   8  -3 41.534  83.069   0.371    3.08    4       39.8        3.6
  171   1   9  -2 41.563  83.126   0.371    3.08    4      144.3       47.6
  172   6   0  -4 41.908  83.816   0.373    3.05    2      145.7       24.0
  173   5   5   0 42.016  84.032   0.374    3.04    4       81.2       14.9
  174   4   6   1 42.423  84.846   0.377    3.0     4       34.9        2.7
  175   1   7   3 42.441  84.881   0.377    3.0     4       36.3        2.9
  176   3   3   3 42.593  85.186   0.378    2.99    4       12.2        0.3
  177   6   4  -2 42.718  85.436   0.379    2.98    4       51.6        5.9
  178   1   3  -5 42.762  85.524   0.38     2.97    4      158.1       55.1
  179   4   6  -4 42.777  85.553   0.38     2.97    4       22.4        1.1
  180   5   3   1 42.82   85.64    0.38     2.97    4       92.7       18.9
  181   5   1  -5 42.839  85.679   0.38     2.97    4       85.7       16.2
  182   2   4  -5 42.917  85.833   0.381    2.96    4       79.7       14.0
  183   6   2  -4 42.984  85.968   0.381    2.96    4       27.7        1.7
  184   0  10   0 43.142  86.284   0.382    2.94    2      118.4       15.3
  185   2   0   4 43.217  86.434   0.383    2.94    2      137.9       20.7
  186   0   8   3 43.304  86.608   0.383    2.93    4       95.2       19.7
  187   6   4  -3 43.37   86.74    0.384    2.93    4       31.2        2.1
  188   0   6   4 43.43   86.86    0.384    2.92    4       73.8       11.8
  189   5   5  -4 43.462  86.924   0.385    2.92    4       35.1        2.7
  190   4   8  -1 43.531  87.062   0.385    2.92    4       82.9       14.9
  191   4   4   2 43.535  87.07    0.385    2.92    4       71.2       11.0
  192   3   9  -1 43.573  87.146   0.385    2.91    4        1.5        0.0
  193   0   0   5 43.592  87.184   0.385    2.91    2       73.3        5.8
  194   4   8  -2 43.601  87.203   0.386    2.91    4      203.0       89.0
  195   2   6   3 43.636  87.272   0.386    2.91    4       49.7        5.3
  196   6   0   0 43.67   87.34    0.386    2.91    2      137.9       20.5
  197   4   4  -5 44.028  88.057   0.389    2.88    4       96.5       19.9
  198   2   8   2 44.091  88.181   0.389    2.88    4      215.1       98.8
  199   3   7  -4 44.148  88.296   0.389    2.88    4        9.1        0.2
  200   0  10   1 44.233  88.466   0.39     2.87    4        4.5        0.0
  201   6   4  -1 44.249  88.498   0.39     2.87    4      110.3       25.9
  202   2   2   4 44.29   88.579   0.39     2.87    4       40.2        3.4
  203   1   5   4 44.441  88.882   0.391    2.86    4        6.5        0.1
  204   3   9  -2 44.444  88.887   0.391    2.86    4      102.7       22.4
  205   1   7  -4 44.474  88.948   0.392    2.86    4       27.4        1.6
  206   0   2   5 44.664  89.328   0.393    2.85    4       72.1       11.0
  207   6   2   0 44.742  89.485   0.393    2.84    4       70.2       10.4
  208   1   9   2 44.77   89.539   0.394    2.84    4       49.6        5.2
  209   5   7  -2 44.814  89.627   0.394    2.84    4       70.1       10.4
  210   3   9   0 44.883  89.766   0.394    2.83    4       47.1        4.7
  211   5   3  -5 44.985  89.97    0.395    2.83    4      123.1       31.8


  X-ray diffraction powder data (I)...X-Ray wave length =  1.78892 (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   1   0   7.693  15.386  6.6817        45.5      7.4      7.5     5.6
    2   0   2   0   7.861  15.721  6.54025      101.3     16.5     16.7     5.6
    3   0   0   1   7.927  15.853  6.48614       24.7      4.0      4.1     5.6
    4   1   1  -1   8.72   17.439  5.9002        92.1     15.0     15.2     5.6
    5   2   0  -1  12.12   24.24   4.26012      437.7     71.3     71.7     5.6
    6   1   1   1  13.038  26.076  3.96488      172.3     28.1     28.2     5.6
    7   2   0   0  13.307  26.614  3.88611       16.5      2.7      2.7     5.6
    8   1   3   0  13.605  27.209  3.80266      511.8     83.4     83.7     5.6
    9   1   3  -1  14.226  28.452  3.63981       87.1     14.2     14.2     5.6
   10   2   2  -1  14.512  29.023  3.56964       57.6      9.4      9.4     5.6
   11   1   1  -2  14.896  29.791  3.47962      280.8     45.8     45.8     5.6
   12   2   2   0  15.529  31.059  3.34085      613.7    100.0    100.0     5.6
   13   2   0  -2  15.7    31.4    3.30547      365.6     59.6     59.6     5.6
   14   0   4   0  15.874  31.748  3.27013      196.4     32.0     32.0     5.6
   15   0   0   2  16.01   32.02   3.24307      518.8     84.5     84.5     5.6
   16   1   3   1  17.287  34.574  3.01008      371.0     60.4     60.3     5.7
   17   2   2  -2  17.65   35.299  2.9501        72.1     11.8     11.7     5.7
   18   0   4   1  17.838  35.675  2.92         154.4     25.2     25.0     5.7
   19   0   2   2  17.93   35.86   2.90548       84.9     13.8     13.8     5.7
   20   3   1  -1  18.533  37.065  2.81413       12.7      2.1      2.1     5.7
   21   1   3  -2  18.765  37.531  2.78048      118.5     19.3     19.2     5.7
   22   3   1  -2  19.932  39.863  2.62384      164.5     26.8     26.6     5.7
   23   2   4  -1  20.171  40.341  2.59401      263.3     42.9     42.5     5.7
   24   1   1   2  20.435  40.87   2.56187       84.1     13.7     13.6     5.7
   25   3   1   0  20.607  41.214  2.54137       87.7     14.3     14.2     5.7
   26   2   4   0  20.946  41.891  2.50211       44.8      7.3      7.2     5.7
   27   1   5   0  21.147  42.293  2.47941       11.4      1.9      1.8     5.7
   28   1   5  -1  21.574  43.148  2.43256       71.9     11.7     11.6     5.7
   29   3   3  -1  21.843  43.686  2.40403       69.3     11.3     11.2     5.7
   30   2   0  -3  22.006  44.011  2.38714       12.2      2.0      2.0     5.7
   31   1   1  -3  22.562  45.123  2.33127       15.0      2.4      2.4     5.7
   32   2   2  -3  23.508  47.016  2.24244       13.2      2.2      2.1     5.7
   33   1   5   1  23.821  47.642  2.21468       34.7      5.6      5.6     5.7
   34   0   6   0  24.223  48.446  2.18008      133.5     21.8     21.4     5.7
   35   2   4   1  24.708  49.416  2.13987       48.2      7.9      7.7     5.7
   36   4   0  -1  24.737  49.474  2.13753        9.4      1.5      1.5     5.7
   37   4   0  -2  24.83   49.659  2.13006       19.2      3.1      3.1     5.7
   38   1   5  -2  24.977  49.954  2.11828       13.6      2.2      2.2     5.7
   39   1   3  -3  25.447  50.893  2.08173       29.5      4.8      4.7     5.8
   40   0   6   1  25.648  51.296  2.06648       31.6      5.1      5.0     5.8
   41   4   2  -2  26.208  52.416  2.02535       90.7     14.8     14.5     5.8
   42   2   2   2  26.82   53.64   1.98244       83.3     13.6     13.3     5.8
   43   3   3  -3  27.052  54.103  1.96673       15.3      2.5      2.4     5.8
   44   4   0   0  27.409  54.818  1.94305       88.3     14.4     14.0     5.8
   45   3   5  -1  27.503  55.005  1.93694       13.6      2.2      2.2     5.8
   46   4   0  -3  27.667  55.333  1.92636       32.3      5.3      5.1     5.8
   47   2   6   0  28.063  56.126  1.90133       22.4      3.6      3.5     5.8
   48   3   3   1  28.122  56.244  1.89767       15.6      2.5      2.5     5.8
   49   1   1   3  28.722  57.445  1.86127       59.1      9.6      9.4     5.8
   50   4   2  -3  28.95   57.9    1.84787       26.6      4.3      4.2     5.8
   51   3   5   0  29.071  58.143  1.84083       24.3      4.0      3.8     5.8
   52   2   6  -2  29.438  58.877  1.8199        30.6      5.0      4.8     5.8
   53   0   6   2  29.628  59.257  1.80928       60.6      9.9      9.6     5.8
   54   2   0  -4  29.709  59.417  1.80484      228.4     37.2     36.0     5.8
   55   4   4  -1  29.995  59.99   1.7892        51.3      8.4      8.1     5.8
   56   4   4  -2  30.076  60.152  1.78482       19.0      3.1      3.0     5.8
   57   2   4   2  30.637  61.273  1.75524       32.9      5.4      5.2     5.8
   58   1   3   3  31.2    62.4    1.72667       14.5      2.4      2.3     5.8
   59   5   1  -2  31.455  62.909  1.71411       12.8      2.1      2.0     5.9
   60   3   5  -3  32.054  64.107  1.6854        54.8      8.9      8.6     5.9
   61   1   7  -2  32.616  65.232  1.65947       29.7      4.8      4.7     5.9
   62   3   5   1  33.022  66.044  1.64133       53.9      8.8      8.4     5.9
   63   5   1  -3  33.061  66.122  1.6396        15.3      2.5      2.4     5.9
   64   3   3  -4  33.092  66.183  1.63827        9.0      1.5      1.4     5.9
   65   0   8   0  33.165  66.33   1.63506        9.8      1.6      1.5     5.9
   66   1   3  -4  33.447  66.894  1.62285        7.2      1.2      1.1     5.9
   67   2   0   3  33.701  67.402  1.61205       10.6      1.7      1.7     5.9
   68   4   2  -4  33.932  67.865  1.60236       40.5      6.6      6.3     5.9
   69   0   8   1  34.344  68.688  1.58546        8.9      1.5      1.4     5.9
   70   2   4  -4  34.476  68.952  1.58015        7.2      1.2      1.1     5.9
   71   0   2   4  34.633  69.266  1.57388       41.3      6.7      6.4     5.9
   72   2   2   3  34.852  69.705  1.56521       11.0      1.8      1.7     5.9
   73   5   3  -3  35.367  70.733  1.54536       64.7     10.5     10.0     5.9
   74   0   6   3  35.638  71.276  1.53513       19.3      3.1      3.0     5.9
   75   4   6  -1  35.876  71.753  1.52628       64.0     10.4      9.9     5.9
   76   2   8   0  36.406  72.811  1.5071       169.6     27.6     26.2     6.0
   77   5   1  -4  36.927  73.853  1.4888        23.1      3.8      3.6     6.0
   78   1   7  -3  37.563  75.126  1.4672        16.8      2.7      2.6     6.0
   79   2   8  -2  37.612  75.225  1.46557       11.2      1.8      1.7     6.0
   80   5   3   0  37.654  75.309  1.46418       24.2      3.9      3.7     6.0
   81   0   8   2  37.781  75.562  1.46          11.2      1.8      1.7     6.0
   82   1   1   4  37.94   75.88   1.4548        30.5      5.0      4.7     6.0
   83   1   5  -4  37.974  75.948  1.45369       11.5      1.9      1.8     6.0
   84   4   6   0  38.071  76.143  1.45054       15.4      2.5      2.4     6.0
   85   2   4   3  38.215  76.43   1.44591       63.1     10.3      9.7     6.0
   86   4   6  -3  38.289  76.577  1.44355       15.9      2.6      2.4     6.0
   87   5   5  -2  38.323  76.647  1.44245       26.9      4.4      4.1     6.0
   88   6   0  -2  38.375  76.75   1.4408        57.9      9.4      8.9     6.0
   89   1   9   0  38.763  77.526  1.42863       12.6      2.0      1.9     6.0
   90   3   5   2  38.992  77.983  1.42156       11.5      1.9      1.8     6.0
   91   1   9  -1  39.06   78.119  1.41949        6.6      1.1      1.0     6.0
   92   4   0   2  39.21   78.419  1.41493       61.8     10.1      9.4     6.0
   93   4   0  -5  39.712  79.424  1.39994       23.4      3.8      3.6     6.0
   94   5   5  -3  39.805  79.611  1.3972        14.2      2.3      2.2     6.0
   95   6   0  -1  39.936  79.873  1.39338        9.4      1.5      1.4     6.0
   96   2   6  -4  40.045  80.089  1.39024       23.0      3.8      3.5     6.0
   97   1   3   4  40.131  80.262  1.38776       22.2      3.6      3.4     6.0
   98   1   1  -5  40.604  81.208  1.37434       12.8      2.1      1.9     6.1
   99   4   2  -5  40.799  81.597  1.36893       19.9      3.2      3.0     6.1
  100   6   2  -1  41.022  82.043  1.36279       17.7      2.9      2.7     6.1
  101   1   9  -2  41.563  83.126  1.34821       51.2      8.3      7.7     6.1
  102   6   0  -4  41.908  83.816  1.33914       24.0      3.9      3.6     6.1
  103   5   5   0  42.016  84.032  1.33634       14.9      2.4      2.2     6.1
  104   1   3  -5  42.762  85.524  1.3174        56.3      9.2      8.4     6.1
  105   5   3   1  42.82   85.64   1.31597       35.1      5.7      5.3     6.1
  106   2   4  -5  42.917  85.833  1.31358       14.0      2.3      2.1     6.1
  107   0  10   0  43.142  86.284  1.30805       15.3      2.5      2.3     6.1
  108   2   0   4  43.217  86.434  1.30623       20.7      3.4      3.1     6.1
  109   0   8   3  43.304  86.608  1.30412       19.7      3.2      2.9     6.1
  110   0   6   4  43.43   86.86   1.30109       11.8      1.9      1.8     6.1
  111   4   8  -1  43.531  87.062  1.29868       25.8      4.2      3.9     6.1
  112   4   8  -2  43.601  87.203  1.297         94.8     15.4     14.2     6.2
  113   6   0   0  43.67   87.34   1.29537       20.5      3.3      3.1     6.2
  114   4   4  -5  44.028  88.057  1.28696       19.9      3.2      3.0     6.2
  115   2   8   2  44.091  88.181  1.28552       98.8     16.1     14.7     6.2
  116   6   4  -1  44.249  88.498  1.28186       25.9      4.2      3.9     6.2
  117   3   9  -2  44.444  88.887  1.27742       24.0      3.9      3.6     6.2
  118   0   2   5  44.664  89.328  1.27244       11.0      1.8      1.6     6.2
  119   6   2   0  44.742  89.485  1.27068       15.6      2.5      2.3     6.2
  120   5   7  -2  44.814  89.627  1.26909       10.4      1.7      1.5     6.2
  121   5   3  -5  44.985  89.97   1.26529       31.8      5.2      4.7     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)