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

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          ***      W W W - X R A Y P O L       ***
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HINGGANITE-(Y)

6, t-datolite, s-gadolinite, DN

[Y(1.3)Dy(0.4)Ca(0.3)]Be(2)Fe(0.24)[SiO(4)](2)(OH)(2)


Monoclinic  P 2(1)/a  Z = 2

R =0.0329          NR =1299

20 .1 .11

Ref.Str.:

         Miyawaki R., Matsubara S., Yokoyama K., Okamoto A. (2007)

         * J. Mineral. Petrol. Sciences, 102, 1-7

         R: N.A.D.

                   Initial data from BDM-file 

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

             a =   9.883    alpha =   90.0 
             b =   7.6091   beta  =   90.34
             c =   4.7423   gamma =   90.0 

    Unit cell volume (cub. angs.) =   356.62

    Molar volume ( cub.cm/mol.) =   107.4 

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

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

   1 0.3324  0.1092  0.0008   0.0    Y     = 0.65, Dy    = 0.2 , Ca    = 0.15
   2 0.3368  0.4148  0.4443   0.0    Be    = 1.00
   3 0.08    0.2753  0.5193   0.0    Si    = 1.00
   4 0.0     0.0     0.0      0.0    Fe    = 0.24, Fe    = 0.0 
   5 0.0324  0.4113  0.7605   0.0    O     = 1.00
   6 0.4517  0.2866  0.3281   0.0    O     = 1.00
   7 0.1973  0.3457  0.3053   0.0    O     = 1.00
   8 0.1473  0.1068  0.6864   0.0    O     = 1.00
   9 0.3318  0.4115  0.7845   0.0    O     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.3324     0.1092     0.0008
     2       2     0.3368     0.4148     0.4443
     3       3     0.08       0.2753     0.5193
     4       4     0.0        0.0        0.0   
     5       5     0.0324     0.4113     0.7605
     6       6     0.4517     0.2866     0.3281
     7       7     0.1973     0.3457     0.3053
     8       8     0.1473     0.1068     0.6864
     9       9     0.3318     0.4115     0.7845
    10       1     0.6676     0.8908     0.9992
    11       2     0.6632     0.5852     0.5557
    12       3     0.92       0.7247     0.4807
    13       5     0.9676     0.5887     0.2395
    14       6     0.5483     0.7134     0.6719
    15       7     0.8027     0.6543     0.6947
    16       8     0.8527     0.8932     0.3136
    17       9     0.6682     0.5885     0.2155
    18       1     0.8324     0.3908     0.0008
    19       2     0.8368     0.0852     0.4443
    20       3     0.58       0.2247     0.5193
    21       4     0.5        0.5        0.0   
    22       5     0.5324     0.0887     0.7605
    23       6     0.9517     0.2134     0.3281
    24       7     0.6973     0.1543     0.3053
    25       8     0.6473     0.3932     0.6864
    26       9     0.8318     0.0885     0.7845
    27       1     0.1676     0.6092     0.9992
    28       2     0.1632     0.9148     0.5557
    29       3     0.42       0.7753     0.4807
    30       5     0.4676     0.9113     0.2395
    31       6     0.0483     0.7866     0.6719
    32       7     0.3027     0.8457     0.6947
    33       8     0.3527     0.6068     0.3136
    34       9     0.1682     0.9115     0.2155


X-ray density (g/cm cub.)   =      4.1 

MU (1/cm) =     453.827    Mass attenuation coefficient (cm**2/g) =    110.714

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

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

    1   Y    ,Dy   ,Ca       2.88         8
                                                 2.3664       6
                                                 2.67         7
                                                 2.3531       8
                                                 2.5188       9
                                                 2.293        5
                                                 2.3056       5
                                                 2.4916       7
                                                 2.4395       9
    2    Be                  2.04         4
                                                 1.5976       6
                                                 1.6127       7
                                                 1.6146       9
                                                 1.5951       8
    3    Si                  2.1          4
                                                 1.6147       5
                                                 1.6352       7
                                                 1.6455       8
                                                 1.6245       6
    4   Fe   ,Fe             2.592        6
                                                 2.2399       8
                                                 2.2399       8
                                                 2.301        6
                                                 2.0593       9
                                                 2.301        6
                                                 2.0593       9
    5    O                   3.264       11
                                                 3.087        7
                                                 2.7581       7
                                                 2.605        8
                                                 2.9605       9
                                                 2.7221       5
                                                 2.8841       5
                                                 2.943        7
                                                 3.1898       6
                                                 2.6625       6
                                                 3.159        9
                                                 2.8909       6
    6    O                   3.264       10
                                                 2.5558       7
                                                 2.65         9
                                                 2.9861       9
                                                 3.1865       9
                                                 2.6625       5
                                                 3.1898       5
                                                 2.6306       7
                                                 2.6912       8
                                                 2.8909       5
                                                 2.6263       8
    7    O                   3.264        9
                                                 2.7581       5
                                                 3.087        5
                                                 2.5558       6
                                                 2.6126       8
                                                 2.6732       9
                                                 2.856        9
                                                 2.943        5
                                                 2.6306       6
                                                 2.5113       8
    8    O                   3.264        9
                                                 2.605        5
                                                 2.6126       7
                                                 2.9844       9
                                                 2.6912       6
                                                 3.1584       9
                                                 2.6263       6
                                                 2.5113       7
                                                 2.9224       9
                                                 2.6914       9
    9    O                   3.264       11
                                                 2.9605       5
                                                 2.9861       6
                                                 2.65         6
                                                 2.856        7
                                                 2.6732       7
                                                 2.9844       8
                                                 3.1865       6
                                                 3.159        5
                                                 3.1584       8
                                                 2.9224       8
                                                 2.6914       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   1   0  7.34   14.68    0.083  119.57    4       43.3      705.5
    2   2   0   0  8.968  17.936   0.101   79.37    2       36.4      165.3
    3   0   0   1  9.348  18.696   0.105   72.88    2       66.0      499.8
    4   2   1   0 10.712  21.424   0.121   54.99    4       32.5      183.2
    5   0   1   1 11.034  22.068   0.124   51.7     4        2.7        1.2
    6   0   2   0 11.681  23.362   0.131   45.91    2        5.3        2.0
    7   1   1  -1 11.905  23.81    0.134   44.12    4       53.4      395.0
    8   1   1   1 11.948  23.896   0.134   43.79    4       36.5      183.1
    9   1   2   0 12.53   25.06    0.141   39.63    4       68.1      577.3
   10   2   0  -1 12.971  25.942   0.146   36.84    2       96.9      544.1
   11   2   0   1 13.05   26.1     0.147   36.37    2       61.0      212.5
   12   2   1  -1 14.254  28.509   0.16    30.16    4      105.8     1062.3
   13   2   1   1 14.327  28.654   0.161   29.83    4      111.4     1165.4
   14   3   1   0 14.762  29.523   0.165   27.99    4       60.1      318.3
   15   2   2   0 14.804  29.609   0.166   27.82    4       35.5      110.3
   16   0   2   1 15.044  30.089   0.168   26.88    4       85.4      617.0
   17   1   2  -1 15.708  31.416   0.176   24.49    4      116.2     1039.6
   18   1   2   1 15.741  31.483   0.176   24.38    4      120.8     1118.7
   19   3   1  -1 17.543  35.085   0.196   19.27    4      116.8      827.0
   20   2   2  -1 17.594  35.189   0.196   19.15    4       32.5       63.5
   21   3   1   1 17.633  35.266   0.197   19.06    4      100.0      599.9
   22   2   2   1 17.654  35.309   0.197   19.01    4       16.4       16.1
   23   3   2   0 18.017  36.034   0.201   18.18    4       14.6       12.2
   24   4   0   0 18.166  36.331   0.202   17.86    2       72.1      146.0
   25   1   3   0 18.272  36.545   0.204   17.63    4       42.1       98.3
   26   0   0   2 18.957  37.914   0.211   16.25    2       88.2      198.9
   27   4   1   0 19.135  38.269   0.213   15.92    4       79.3      314.8
   28   0   1   2 19.893  39.786   0.221   14.61    4       17.9       14.7
   29   2   3   0 19.96   39.92    0.222   14.5     4      105.2      505.1
   30   0   3   1 20.145  40.291   0.224   14.2     4       61.5      169.3
   31   1   1  -2 20.405  40.809   0.226   13.81    4        7.7        2.6
   32   3   2  -1 20.408  40.816   0.226   13.8     4       63.6      175.4
   33   1   1   2 20.458  40.915   0.227   13.73    4       64.7      180.8
   34   3   2   1 20.487  40.975   0.227   13.68    4       76.3      250.7
   35   4   0  -1 20.529  41.058   0.228   13.62    2       87.9      165.4
   36   4   0   1 20.634  41.268   0.229   13.47    2       33.2       23.3
   37   1   3  -1 20.665  41.329   0.229   13.42    4       51.5      111.8
   38   1   3   1 20.691  41.382   0.229   13.38    4        2.2        0.2
   39   2   0  -2 21.069  42.137   0.233   12.85    2        3.5        0.3
   40   2   0   2 21.172  42.343   0.234   12.71    2       69.2       95.8
   41   4   1  -1 21.408  42.815   0.237   12.4     4       30.0       35.2
   42   4   1   1 21.509  43.019   0.238   12.27    4       66.3      169.7
   43   4   2   0 21.823  43.646   0.241   11.88    4        0.6        0.0
   44   2   1  -2 21.93   43.859   0.242   11.75    4       40.6       60.8
   45   2   1   2 22.029  44.059   0.243   11.63    4       42.4       65.8
   46   2   3  -1 22.187  44.375   0.245   11.44    4       51.5       95.5
   47   2   3   1 22.237  44.474   0.246   11.38    4       86.0      264.6
   48   0   2   2 22.506  45.013   0.248   11.08    4        4.4        0.7
   49   3   3   0 22.537  45.074   0.249   11.05    4       56.1      109.4
   50   1   2  -2 22.97   45.941   0.253   10.58    4      109.9      401.7
   51   1   2   2 23.018  46.037   0.254   10.53    4      107.0      378.9
   52   5   1   0 23.743  47.487   0.261    9.82    4       41.7       53.7
   53   0   4   0 23.886  47.773   0.263    9.68    2      112.2      191.7
   54   4   2  -1 23.887  47.773   0.263    9.68    4        2.9        0.3
   55   4   2   1 23.98   47.96    0.264    9.6     4       24.4       18.0
   56   3   1  -2 24.316  48.631   0.267    9.3     4      119.9      420.6
   57   1   4   0 24.353  48.706   0.268    9.27    4       49.3       71.0
   58   2   2  -2 24.367  48.734   0.268    9.25    4       26.0       19.7
   59   3   1   2 24.454  48.908   0.269    9.18    4      114.2      376.8
   60   2   2   2 24.459  48.918   0.269    9.18    4       16.2        7.5
   61   3   3  -1 24.565  49.131   0.27     9.09    4       40.4       46.6
   62   3   3   1 24.634  49.268   0.271    9.03    4       37.5       40.0
   63   5   1  -1 25.677  51.354   0.281    8.21    4       25.9       17.4
   64   2   4   0 25.715  51.43    0.282    8.19    4       94.8      231.3
   65   5   1   1 25.788  51.575   0.282    8.13    4       50.2       64.6
   66   4   3   0 25.8    51.6     0.283    8.13    4       90.4      208.7
   67   0   4   1 25.867  51.735   0.283    8.08    4      113.9      329.5
   68   5   2   0 26.05   52.101   0.285    7.95    4      114.3      326.9
   69   1   4  -1 26.297  52.594   0.288    7.78    4       27.0       17.9
   70   1   4   1 26.319  52.638   0.288    7.77    4       13.6        4.5
   71   0   3   2 26.405  52.809   0.289    7.71    4        0.6        0.0
   72   3   2  -2 26.586  53.172   0.291    7.59    4        1.2        0.0
   73   4   0  -2 26.674  53.348   0.291    7.53    2       47.4       26.6
   74   3   2   2 26.716  53.431   0.292    7.51    4       22.4       11.8
   75   1   3  -2 26.818  53.635   0.293    7.44    4       33.2       25.8
   76   4   0   2 26.846  53.693   0.293    7.42    2       75.6       66.8
   77   1   3   2 26.861  53.721   0.293    7.41    4       65.6      100.4
   78   4   1  -2 27.399  54.798   0.299    7.09    4      114.3      291.2
   79   4   1   2 27.568  55.137   0.3      6.99    4       84.7      157.7
   80   2   4  -1 27.579  55.158   0.301    6.98    4       28.2       17.5
   81   2   4   1 27.621  55.243   0.301    6.96    4       37.5       30.7
   82   4   3  -1 27.639  55.279   0.301    6.95    4      104.6      238.8
   83   4   3   1 27.724  55.447   0.302    6.9     4      107.8      252.2
   84   5   2  -1 27.868  55.735   0.303    6.82    4       62.3       83.1
   85   3   4   0 27.878  55.756   0.304    6.81    4       18.8        7.5
   86   6   0   0 27.882  55.763   0.304    6.81    2      122.4      160.3
   87   5   2   1 27.972  55.944   0.304    6.76    4       88.7      167.2
   88   2   3  -2 28.073  56.146   0.305    6.71    4      124.8      328.7
   89   2   3   2 28.156  56.313   0.306    6.66    4      111.2      258.9
   90   6   1   0 28.586  57.172   0.311    6.44    4        0.0        0.0
   91   0   0   3 29.163  58.325   0.316    6.15    2      107.1      111.1
   92   4   2  -2 29.502  59.004   0.32     5.99    4       13.9        3.6
   93   5   3   0 29.608  59.216   0.321    5.95    4       35.1       23.1
   94   6   0  -1 29.613  59.226   0.321    5.94    2      130.4      159.0
   95   3   4  -1 29.639  59.279   0.321    5.93    4       35.0       22.9
   96   4   2   2 29.664  59.327   0.321    5.92    4       40.4       30.4
   97   3   4   1 29.7    59.399   0.322    5.91    4       12.6        3.0
   98   6   0   1 29.734  59.467   0.322    5.89    2      138.7      178.2
   99   0   1   3 29.848  59.695   0.323    5.84    4        2.4        0.1
  100   3   3  -2 30.101  60.202   0.326    5.73    4       32.5       19.1
  101   1   1  -3 30.219  60.439   0.327    5.68    4       28.7       14.7
  102   3   3   2 30.221  60.442   0.327    5.68    4       33.8       20.4
  103   1   1   3 30.279  60.558   0.327    5.66    4       16.5        4.8
  104   6   1  -1 30.292  60.583   0.327    5.65    4        9.2        1.5
  105   6   1   1 30.411  60.821   0.329    5.6     4       11.1        2.2
  106   6   2   0 30.637  61.274   0.331    5.51    4       73.5       93.5
  107   2   0  -3 30.712  61.425   0.332    5.48    2       78.0       52.4
  108   4   4   0 30.733  61.466   0.332    5.47    4       52.1       46.8
  109   1   5   0 30.805  61.611   0.332    5.44    4       41.7       29.8
  110   2   0   3 30.831  61.661   0.333    5.43    2       39.6       13.4
  111   5   1  -2 31.057  62.114   0.335    5.35    4       34.2       19.6
  112   5   1   2 31.253  62.505   0.337    5.27    4        6.8        0.8
  113   0   4   2 31.274  62.548   0.337    5.26    4       32.5       17.5
  114   5   3  -1 31.289  62.578   0.337    5.26    4       39.0       25.1
  115   2   1  -3 31.377  62.754   0.338    5.23    4       66.7       73.0
  116   5   3   1 31.386  62.773   0.338    5.22    4       38.3       24.1
  117   2   1   3 31.494  62.987   0.339    5.18    4       69.3       78.3
  118   1   4  -2 31.646  63.291   0.341    5.13    4       26.5       11.4
  119   1   4   2 31.684  63.369   0.341    5.12    4       48.6       38.0
  120   0   2   3 31.849  63.697   0.343    5.06    4       34.0       18.3
  121   2   5   0 31.98   63.959   0.344    5.01    4       23.0        8.4
  122   0   5   1 32.112  64.225   0.345    4.97    4       17.2        4.6
  123   1   2  -3 32.207  64.414   0.346    4.94    4       93.3      135.0
  124   1   2   3 32.264  64.529   0.347    4.92    4       97.6      147.4
  125   6   2  -1 32.277  64.553   0.347    4.91    4        3.2        0.2
  126   4   4  -1 32.389  64.779   0.348    4.88    4       60.7       56.6
  127   6   2   1 32.391  64.783   0.348    4.88    4       10.3        1.6
  128   4   4   1 32.466  64.932   0.348    4.85    4       49.0       36.7
  129   1   5  -1 32.488  64.976   0.349    4.84    4       66.7       67.7
  130   1   5   1 32.507  65.014   0.349    4.84    4       79.3       95.6
  131   2   4  -2 32.784  65.568   0.351    4.75    4       59.2       52.4
  132   4   3  -2 32.819  65.638   0.352    4.74    4       33.7       16.9
  133   2   4   2 32.86   65.72    0.352    4.73    4       57.5       49.1
  134   4   3   2 32.971  65.942   0.353    4.69    4       36.1       19.2
  135   5   2  -2 33.016  66.032   0.354    4.68    4       74.8       82.3
  136   5   2   2 33.205  66.41    0.355    4.62    4       64.3       60.1
  137   3   1  -3 33.274  66.549   0.356    4.6     4       86.4      108.1
  138   2   2  -3 33.326  66.651   0.357    4.59    4       12.5        2.3
  139   2   2   3 33.439  66.877   0.358    4.56    4        0.6        0.0
  140   3   1   3 33.444  66.888   0.358    4.55    4       97.0      134.7
  141   2   5  -1 33.621  67.241   0.359    4.5     4        2.4        0.1
  142   2   5   1 33.658  67.317   0.36     4.49    4       21.8        6.7
  143   7   1   0 33.704  67.408   0.36     4.48    4        1.7        0.0
  144   3   5   0 33.887  67.774   0.362    4.43    4       36.0       18.1
  145   6   3   0 33.89   67.781   0.362    4.43    4       11.2        1.7
  146   5   4   0 34.194  68.387   0.365    4.35    4       11.7        1.9
  147   6   0  -2 34.598  69.196   0.369    4.24    2       45.9       14.1
  148   3   4  -2 34.65   69.3     0.369    4.23    4        4.4        0.3
  149   3   4   2 34.761  69.522   0.37     4.2     4       36.2       17.3
  150   6   0   2 34.82   69.64    0.371    4.19    2       54.6       19.7
  151   0   3   3 35.042  70.084   0.373    4.13    4       43.7       24.9
  152   3   2  -3 35.169  70.337   0.374    4.1     4       46.0       27.4
  153   6   1  -2 35.224  70.447   0.374    4.09    4        6.5        0.5
  154   4   0  -3 35.234  70.468   0.374    4.09    2        6.0        0.2
  155   7   1  -1 35.259  70.518   0.375    4.08    4       28.3       10.3
  156   3   2   3 35.334  70.668   0.375    4.07    4       17.7        4.0
  157   1   3  -3 35.384  70.768   0.376    4.05    4        0.3        0.0
  158   7   1   1 35.387  70.775   0.376    4.05    4       49.5       31.3
  159   1   3   3 35.439  70.878   0.376    4.04    4       19.0        4.6
  160   6   1   2 35.444  70.888   0.376    4.04    4        8.9        1.0
  161   6   3  -1 35.451  70.901   0.376    4.04    4       20.4        5.3
  162   4   0   3 35.454  70.909   0.377    4.04    2       44.9       12.8
  163   3   5  -1 35.475  70.949   0.377    4.03    4       99.7      126.0
  164   3   5   1 35.53   71.059   0.377    4.02    4       85.4       92.3
  165   6   3   1 35.561  71.121   0.378    4.02    4       24.8        7.8
  166   7   2   0 35.587  71.175   0.378    4.01    4       47.8       28.8
  167   5   4  -1 35.757  71.514   0.379    3.97    4       57.5       41.2
  168   5   4   1 35.848  71.697   0.38     3.95    4       36.5       16.5
  169   4   1  -3 35.855  71.71    0.38     3.95    4        4.7        0.3
  170   4   1   3 36.073  72.147   0.382    3.9     4        3.8        0.2
  171   5   3  -2 36.158  72.317   0.383    3.89    4        9.1        1.0
  172   5   3   2 36.34   72.68    0.385    3.85    4        7.9        0.7
  173   2   3  -3 36.456  72.911   0.386    3.83    4       32.2       12.5
  174   4   5   0 36.475  72.949   0.386    3.82    4       14.4        2.5
  175   2   3   3 36.564  73.129   0.387    3.8     4       14.2        2.4
  176   0   5   2 36.973  73.946   0.39     3.72    4        2.4        0.1
  177   6   2  -2 37.073  74.146   0.391    3.71    4       36.3       15.4
  178   7   2  -1 37.107  74.215   0.392    3.7     4       90.1       94.5
  179   4   4  -2 37.197  74.394   0.392    3.68    4       48.0       26.7
  180   7   2   1 37.233  74.467   0.393    3.68    4       72.3       60.4
  181   6   2   2 37.289  74.578   0.393    3.67    4       55.0       34.9
  182   1   5  -2 37.317  74.633   0.394    3.66    4        8.5        0.8
  183   4   4   2 37.341  74.681   0.394    3.66    4       19.5        4.4
  184   1   5   2 37.353  74.705   0.394    3.66    4       36.5       15.3
  185   0   6   0 37.401  74.802   0.394    3.65    2       92.1       48.6
  186   4   2  -3 37.692  75.384   0.397    3.6     4        3.6        0.1
  187   1   6   0 37.761  75.522   0.397    3.58    4       80.2       72.5
  188   4   2   3 37.906  75.813   0.399    3.56    4       34.5       13.3
  189   4   5  -1 38.008  76.016   0.4      3.54    4       41.2       18.9
  190   4   5   1 38.079  76.158   0.4      3.53    4       48.4       26.0
  191   6   4   0 38.214  76.427   0.402    3.51    4      127.7      180.1
  192   3   3  -3 38.233  76.467   0.402    3.51    4       48.9       26.4
  193   2   5  -2 38.376  76.753   0.403    3.48    4       52.8       30.6
  194   3   3   3 38.394  76.787   0.403    3.48    4       44.4       21.6
  195   2   5   2 38.448  76.895   0.404    3.47    4       43.0       20.2
  196   8   0   0 38.574  77.149   0.405    3.45    2       85.5       39.7
  197   7   3   0 38.639  77.279   0.405    3.44    4        2.9        0.1
  198   2   6   0 38.834  77.669   0.407    3.41    4       12.5        1.7
  199   0   6   1 38.957  77.913   0.408    3.4     4       24.5        6.4
  200   5   1  -3 39.074  78.148   0.409    3.38    4       44.4       21.0
  201   8   1   0 39.175  78.35    0.41     3.36    4       77.4       63.4
  202   1   6  -1 39.303  78.607   0.411    3.35    4       67.6       48.2
  203   0   4   3 39.314  78.629   0.411    3.35    4      101.2      107.7
  204   1   6   1 39.321  78.642   0.411    3.34    4       31.7       10.6
  205   5   1   3 39.339  78.678   0.411    3.34    4       42.5       19.0
  206   1   4  -3 39.643  79.285   0.414    3.3     4       50.6       26.5
  207   1   4   3 39.695  79.391   0.415    3.29    4       34.6       12.4
  208   5   5   0 39.702  79.405   0.415    3.29    4       65.3       44.1
  209   6   4  -1 39.707  79.413   0.415    3.29    4       60.3       37.6
  210   6   4   1 39.812  79.624   0.416    3.28    4       31.9       10.5
  211   7   1  -2 39.893  79.786   0.416    3.27    4       16.1        2.7
  212   8   0  -1 40.046  80.092   0.418    3.25    2       40.6        8.4
  213   6   3  -2 40.085  80.171   0.418    3.24    4       18.2        3.4
  214   7   3  -1 40.119  80.238   0.418    3.24    4       52.4       27.9
  215   3   5  -2 40.135  80.27    0.418    3.24    4      108.9      120.8
  216   7   1   2 40.139  80.278   0.418    3.24    4       45.4       21.0
  217   8   0   1 40.186  80.373   0.419    3.23    2        6.1        0.2
  218   3   5   2 40.24   80.481   0.419    3.23    4      104.0      109.6
  219   7   3   1 40.242  80.484   0.419    3.22    4       28.3        8.1
  220   6   3   2 40.296  80.593   0.42     3.22    4       16.4        2.7
  221   2   6  -1 40.356  80.712   0.42     3.21    4       53.2       28.6
  222   5   4  -2 40.388  80.777   0.421    3.21    4        4.8        0.2
  223   2   6   1 40.391  80.782   0.421    3.21    4       28.6        8.2
  224   0   0   4 40.521  81.041   0.422    3.19    2      136.3       93.3
  225   5   4   2 40.564  81.127   0.422    3.19    4       27.0        7.3
  226   3   6   0 40.605  81.21    0.422    3.18    4       35.9       12.9
  227   8   1  -1 40.641  81.282   0.423    3.18    4        7.5        0.6
  228   2   4  -3 40.676  81.351   0.423    3.17    4       46.0       21.1
  229   4   3  -3 40.69   81.381   0.423    3.17    4       87.6       76.6
  230   2   4   3 40.781  81.561   0.424    3.16    4       49.8       24.7
  231   8   1   1 40.781  81.562   0.424    3.16    4       33.0       10.8
  232   5   2  -3 40.863  81.726   0.425    3.15    4       91.0       82.2
  233   4   3   3 40.9    81.801   0.425    3.15    4       73.0       52.8
  234   8   2   0 40.963  81.927   0.426    3.14    4       22.3        4.9
  235   0   1   4 41.114  82.228   0.427    3.13    4       30.0        8.8
  236   5   2   3 41.125  82.251   0.427    3.12    4       85.5       71.8
  237   5   5  -1 41.19   82.379   0.427    3.12    4       14.9        2.2
  238   5   5   1 41.277  82.554   0.428    3.11    4       53.5       28.0
  239   1   1  -4 41.43   82.86    0.43     3.09    4       54.1       28.4
  240   1   1   4 41.5    83.0     0.43     3.09    4       21.8        4.6
  241   7   2  -2 41.674  83.348   0.432    3.07    4       97.0       90.8
  242   2   0  -4 41.856  83.711   0.433    3.05    2       25.2        3.1
  243   7   2   2 41.918  83.836   0.434    3.05    4      102.2      100.0
  244   2   0   4 41.995  83.99    0.434    3.04    2       22.8        2.5
  245   3   6  -1 42.103  84.206   0.435    3.03    4       40.0       15.2
  246   3   6   1 42.155  84.311   0.436    3.02    4       21.1        4.2
  247   6   0  -3 42.328  84.655   0.437    3.01    2      118.8       66.7
  248   3   4  -3 42.403  84.805   0.438    3.0     4        5.8        0.3
  249   8   2  -1 42.416  84.831   0.438    3.0     4       24.3        5.6
  250   2   1  -4 42.446  84.891   0.438    3.0     4       33.9       10.9
  251   8   2   1 42.555  85.109   0.439    2.99    4       26.3        6.5
  252   3   4   3 42.559  85.118   0.439    2.99    4       26.4        6.5
  253   4   5  -2 42.575  85.149   0.439    2.99    4       16.1        2.4
  254   2   1   4 42.585  85.169   0.439    2.99    4       14.1        1.9
  255   6   0   3 42.641  85.281   0.44     2.98    2      113.7       60.6
  256   4   5   2 42.714  85.427   0.44     2.98    4       13.5        1.7
  257   7   4   0 42.8    85.599   0.441    2.97    4       16.2        2.5
  258   0   2   4 42.886  85.771   0.442    2.96    4       10.0        0.9
  259   6   1  -3 42.917  85.834   0.442    2.96    4       33.7       10.5
  260   4   6   0 43.057  86.114   0.443    2.95    4       44.0       18.0
  261   1   2  -4 43.2    86.399   0.444    2.94    4       70.4       45.8
  262   6   1   3 43.229  86.459   0.445    2.94    4        6.4        0.4
  263   1   2   4 43.269  86.538   0.445    2.93    4       47.8       21.1
  264   0   6   2 43.536  87.072   0.447    2.91    4       43.5       17.4
  265   6   5   0 43.561  87.121   0.447    2.91    4        5.6        0.3
  266   5   3  -3 43.813  87.626   0.449    2.9     4       44.7       18.2
  267   1   6  -2 43.867  87.734   0.45     2.89    4       53.2       25.7
  268   1   6   2 43.902  87.803   0.45     2.89    4       87.3       69.3
  269   8   3   0 43.912  87.825   0.45     2.89    4       34.2       10.6
  270   5   3   3 44.073  88.146   0.452    2.88    4       45.9       19.1
  271   3   1  -4 44.155  88.309   0.452    2.87    4       52.7       25.1
  272   2   2  -4 44.21   88.421   0.453    2.87    4       20.0        3.6
  273   6   4  -2 44.22   88.439   0.453    2.87    4       63.4       36.3
  274   7   4  -1 44.253  88.505   0.453    2.87    4       35.7       11.5
  275   2   2   4 44.349  88.698   0.454    2.86    4        1.0        0.0
  276   3   1   4 44.362  88.725   0.454    2.86    4       61.4       33.9
  277   7   4   1 44.374  88.748   0.454    2.86    4       26.0        6.1
  278   6   4   2 44.427  88.855   0.454    2.86    4       95.2       81.5
  279   4   6  -1 44.536  89.071   0.455    2.85    4       22.3        4.5
  280   8   0  -2 44.536  89.072   0.455    2.85    2       28.3        3.6
  281   4   6   1 44.605  89.21    0.456    2.85    4        9.9        0.9
  282   7   3  -2 44.617  89.234   0.456    2.85    4        7.3        0.5
  283   0   5   3 44.636  89.272   0.456    2.85    4        5.6        0.3
  284   6   2  -3 44.68   89.36    0.456    2.84    4        1.6        0.0
  285   8   0   2 44.813  89.627   0.457    2.84    2       59.5       15.8
  286   4   4  -3 44.817  89.633   0.458    2.84    4       36.5       11.9
  287   7   3   2 44.86   89.719   0.458    2.84    4       31.1        8.6
  288   2   6  -2 44.894  89.788   0.458    2.83    4       14.5        1.9
  289   1   5  -3 44.958  89.916   0.459    2.83    4       79.3       56.0
  290   2   6   2 44.963  89.927   0.459    2.83    4       51.4       23.5
  291   6   2   3 44.992  89.984   0.459    2.83    4       10.0        0.9


  X-ray diffraction powder data (I)...X-Ray wave length =  1.54056 (angs.):

  No   H   K   L   Theta 2*Theta    d           I int   I int.n.  I p.h.n.   H(Si)
                    ( degree )   (angstrem)     *100                         *100

    1   1   1   0   7.34   14.68   6.02911      705.5     60.5     61.1     5.6
    2   2   0   0   8.968  17.936  4.94141      165.3     14.2     14.3     5.6
    3   0   0   1   9.348  18.696  4.74222      499.8     42.9     43.2     5.6
    4   2   1   0  10.712  21.424  4.14422      183.2     15.7     15.8     5.6
    5   1   1  -1  11.905  23.81   3.73399      395.0     33.9     34.0     5.6
    6   1   1   1  11.948  23.896  3.72079      183.1     15.7     15.8     5.6
    7   1   2   0  12.53   25.06   3.55054      577.3     49.5     49.7     5.6
    8   2   0  -1  12.971  25.942  3.43176      544.1     46.7     46.8     5.6
    9   2   0   1  13.05   26.1    3.41135      212.5     18.2     18.3     5.6
   10   2   1  -1  14.254  28.509  3.12831     1062.3     91.2     91.2     5.6
   11   2   1   1  14.327  28.654  3.11283     1165.4    100.0    100.0     5.6
   12   3   1   0  14.762  29.523  3.02312      318.3     27.3     27.3     5.6
   13   2   2   0  14.804  29.609  3.01456      110.3      9.5      9.5     5.6
   14   0   2   1  15.044  30.089  2.96756      617.0     52.9     52.9     5.6
   15   1   2  -1  15.708  31.416  2.84512     1039.6     89.2     89.0     5.6
   16   1   2   1  15.741  31.483  2.83927     1118.7     96.0     95.8     5.6
   17   3   1  -1  17.543  35.085  2.55554      827.0     71.0     70.6     5.7
   18   2   2  -1  17.594  35.189  2.54825       63.5      5.5      5.4     5.7
   19   3   1   1  17.633  35.266  2.54288      616.0     52.9     52.6     5.7
   20   3   2   0  18.017  36.034  2.49042       12.2      1.1      1.0     5.7
   21   4   0   0  18.166  36.331  2.47071      146.0     12.5     12.4     5.7
   22   1   3   0  18.272  36.545  2.45675       98.3      8.4      8.4     5.7
   23   0   0   2  18.957  37.914  2.37111      198.9     17.1     16.9     5.7
   24   4   1   0  19.135  38.269  2.34993      314.8     27.0     26.8     5.7
   25   0   1   2  19.893  39.786  2.26374       14.7      1.3      1.2     5.7
   26   2   3   0  19.96   39.92   2.25647      505.1     43.3     42.9     5.7
   27   0   3   1  20.145  40.291  2.23656      169.3     14.5     14.4     5.7
   28   3   2  -1  20.408  40.816  2.20897      178.0     15.3     15.1     5.7
   29   1   1   2  20.458  40.915  2.20387      180.8     15.5     15.3     5.7
   30   3   2   1  20.487  40.975  2.20078      250.7     21.5     21.3     5.7
   31   4   0  -1  20.529  41.058  2.19653      165.4     14.2     14.0     5.7
   32   4   0   1  20.634  41.268  2.18581       23.3      2.0      2.0     5.7
   33   1   3  -1  20.665  41.329  2.18272      112.0      9.6      9.5     5.7
   34   2   0   2  21.172  42.343  2.13278       95.8      8.2      8.1     5.7
   35   4   1  -1  21.408  42.815  2.11036       35.2      3.0      3.0     5.7
   36   4   1   1  21.509  43.019  2.10085      169.7     14.6     14.4     5.7
   37   2   1  -2  21.93   43.859  2.06251       60.8      5.2      5.1     5.7
   38   2   1   2  22.029  44.059  2.05363       65.8      5.6      5.6     5.7
   39   2   3  -1  22.187  44.375  2.03973       95.5      8.2      8.1     5.7
   40   2   3   1  22.237  44.474  2.03542      264.6     22.7     22.4     5.7
   41   3   3   0  22.537  45.074  2.0097       109.4      9.4      9.2     5.7
   42   1   2  -2  22.97   45.941  1.97379      401.7     34.5     33.9     5.7
   43   1   2   2  23.018  46.037  1.96988      378.9     32.5     32.0     5.7
   44   5   1   0  23.743  47.487  1.91307       53.7      4.6      4.5     5.7
   45   0   4   0  23.886  47.773  1.90228      192.0     16.5     16.2     5.7
   46   4   2   1  23.98   47.96   1.89528       18.0      1.5      1.5     5.7
   47   3   1  -2  24.316  48.631  1.87069      420.6     36.1     35.4     5.7
   48   1   4   0  24.353  48.706  1.86799       90.7      7.8      7.6     5.7
   49   3   1   2  24.454  48.908  1.86076      384.4     33.0     32.3     5.7
   50   3   3  -1  24.565  49.131  1.85282       46.6      4.0      3.9     5.7
   51   3   3   1  24.634  49.268  1.84798       40.0      3.4      3.4     5.7
   52   5   1  -1  25.677  51.354  1.77772       17.4      1.5      1.5     5.8
   53   2   4   0  25.715  51.43   1.77527      231.3     19.8     19.4     5.8
   54   4   3   0  25.8    51.6    1.76981      273.3     23.5     22.9     5.8
   55   0   4   1  25.867  51.735  1.76553      329.5     28.3     27.6     5.8
   56   5   2   0  26.05   52.101  1.75398      326.9     28.1     27.4     5.8
   57   1   4  -1  26.297  52.594  1.73868       22.4      1.9      1.9     5.8
   58   4   0  -2  26.674  53.348  1.71588       26.6      2.3      2.2     5.8
   59   3   2   2  26.716  53.431  1.7134        11.8      1.0      1.0     5.8
   60   1   3   2  26.861  53.721  1.70484      193.1     16.6     16.1     5.8
   61   4   1  -2  27.399  54.798  1.67385      291.2     25.0     24.3     5.8
   62   4   1   2  27.568  55.137  1.66437      175.2     15.0     14.6     5.8
   63   4   3  -1  27.639  55.279  1.66043      269.6     23.1     22.5     5.8
   64   4   3   1  27.724  55.447  1.65579      252.2     21.6     21.0     5.8
   65   6   0   0  27.882  55.763  1.64714      251.0     21.5     20.9     5.8
   66   5   2   1  27.972  55.944  1.64224      167.2     14.3     13.9     5.8
   67   2   3  -2  28.073  56.146  1.63682      328.7     28.2     27.4     5.8
   68   2   3   2  28.156  56.313  1.63237      258.9     22.2     21.6     5.8
   69   0   0   3  29.163  58.325  1.58074      111.1      9.5      9.2     5.8
   70   6   0  -1  29.613  59.226  1.55884      182.0     15.6     15.1     5.8
   71   4   2   2  29.664  59.327  1.55642       53.3      4.6      4.4     5.8
   72   6   0   1  29.734  59.467  1.55308      178.2     15.3     14.8     5.8
   73   3   3  -2  30.101  60.202  1.53586       19.1      1.6      1.6     5.8
   74   3   3   2  30.221  60.442  1.53036       35.1      3.0      2.9     5.8
   75   6   2   0  30.637  61.274  1.51156       93.5      8.0      7.7     5.8
   76   2   0  -3  30.712  61.425  1.50819       99.2      8.5      8.2     5.8
   77   1   5   0  30.805  61.611  1.50409       43.2      3.7      3.6     5.8
   78   5   1  -2  31.057  62.114  1.49311       19.6      1.7      1.6     5.8
   79   5   3  -1  31.289  62.578  1.48315       42.6      3.7      3.5     5.8
   80   2   1  -3  31.377  62.754  1.47941       97.1      8.3      8.0     5.9
   81   2   1   3  31.494  62.987  1.47449       78.3      6.7      6.5     5.9
   82   1   4   2  31.684  63.369  1.46653       38.0      3.3      3.1     5.9
   83   0   2   3  31.849  63.697  1.45975       18.3      1.6      1.5     5.9
   84   1   2  -3  32.207  64.414  1.44524      135.0     11.6     11.1     5.9
   85   1   2   3  32.264  64.529  1.44294      147.6     12.7     12.1     5.9
   86   4   4  -1  32.389  64.779  1.43798       58.2      5.0      4.8     5.9
   87   1   5  -1  32.488  64.976  1.43408      200.0     17.2     16.5     5.9
   88   2   4  -2  32.784  65.568  1.42256       52.4      4.5      4.3     5.9
   89   4   3  -2  32.819  65.638  1.42121       16.9      1.5      1.4     5.9
   90   2   4   2  32.86   65.72   1.41964       49.1      4.2      4.0     5.9
   91   4   3   2  32.971  65.942  1.41539       19.2      1.6      1.6     5.9
   92   5   2  -2  33.016  66.032  1.41369       82.3      7.1      6.8     5.9
   93   5   2   2  33.205  66.41   1.40655       60.1      5.2      4.9     5.9
   94   3   1  -3  33.274  66.549  1.40396      108.1      9.3      8.9     5.9
   95   3   1   3  33.444  66.888  1.39766      134.7     11.6     11.0     5.9
   96   3   5   0  33.887  67.774  1.38153       19.8      1.7      1.6     5.9
   97   6   0  -2  34.598  69.196  1.35657       14.1      1.2      1.1     5.9
   98   3   4   2  34.761  69.522  1.35099       17.3      1.5      1.4     5.9
   99   6   0   2  34.82   69.64   1.349         19.7      1.7      1.6     5.9
  100   0   3   3  35.042  70.084  1.34153       24.9      2.1      2.0     5.9
  101   3   2  -3  35.169  70.337  1.33733       27.4      2.3      2.2     5.9
  102   7   1   1  35.387  70.775  1.33013       31.3      2.7      2.5     5.9
  103   3   5  -1  35.475  70.949  1.32728      149.8     12.9     12.2     5.9
  104   3   5   1  35.53   71.059  1.3255        92.3      7.9      7.5     5.9
  105   7   2   0  35.587  71.175  1.32363       36.6      3.1      3.0     5.9
  106   5   4  -1  35.757  71.514  1.31818       41.2      3.5      3.4     5.9
  107   5   4   1  35.848  71.697  1.31528       16.8      1.4      1.4     5.9
  108   2   3  -3  36.456  72.911  1.29633       15.0      1.3      1.2     6.0
  109   6   2  -2  37.073  74.146  1.27777       15.4      1.3      1.2     6.0
  110   7   2  -1  37.107  74.215  1.27675       94.5      8.1      7.6     6.0
  111   4   4  -2  37.197  74.394  1.27413       26.7      2.3      2.2     6.0
  112   7   2   1  37.233  74.467  1.27306       60.4      5.2      4.9     6.0
  113   6   2   2  37.289  74.578  1.27144       35.8      3.1      2.9     6.0
  114   1   5   2  37.353  74.705  1.26959       19.7      1.7      1.6     6.0
  115   0   6   0  37.401  74.802  1.26818       48.6      4.2      3.9     6.0
  116   1   6   0  37.761  75.522  1.25787       72.5      6.2      5.9     6.0
  117   4   2   3  37.906  75.813  1.25376       13.3      1.1      1.1     6.0
  118   4   5  -1  38.008  76.016  1.25092       18.9      1.6      1.5     6.0
  119   4   5   1  38.079  76.158  1.24893       26.0      2.2      2.1     6.0
  120   6   4   0  38.214  76.427  1.24521      206.4     17.7     16.6     6.0
  121   2   5  -2  38.376  76.753  1.24074       52.2      4.5      4.2     6.0
  122   2   5   2  38.448  76.895  1.23879       20.2      1.7      1.6     6.0
  123   8   0   0  38.574  77.149  1.23535       39.7      3.4      3.2     6.0
  124   5   1  -3  39.074  78.148  1.22204       21.0      1.8      1.7     6.0
  125   8   1   0  39.175  78.35   1.21939       63.4      5.4      5.1     6.0
  126   0   4   3  39.314  78.629  1.21577      185.4     15.9     14.9     6.0
  127   1   4  -3  39.643  79.285  1.20734       26.5      2.3      2.1     6.0
  128   6   4  -1  39.707  79.413  1.20572       94.1      8.1      7.5     6.0
  129   3   5  -2  40.135  80.27   1.19499      169.7     14.6     13.5     6.0
  130   3   5   2  40.24   80.481  1.19239      117.8     10.1      9.4     6.0
  131   2   6  -1  40.356  80.712  1.18956       28.6      2.5      2.3     6.1
  132   0   0   4  40.521  81.041  1.18555       93.3      8.0      7.4     6.1
  133   3   6   0  40.605  81.21   1.18351       12.9      1.1      1.0     6.1
  134   4   3  -3  40.69   81.381  1.18146       97.7      8.4      7.8     6.1
  135   2   4   3  40.781  81.561  1.1793        35.5      3.0      2.8     6.1
  136   5   2  -3  40.863  81.726  1.17734       82.2      7.1      6.5     6.1
  137   4   3   3  40.9    81.801  1.17645       52.8      4.5      4.2     6.1
  138   5   2   3  41.125  82.251  1.17116       80.7      6.9      6.4     6.1
  139   5   5   1  41.277  82.554  1.16762       28.0      2.4      2.2     6.1
  140   1   1  -4  41.43   82.86   1.16408       28.4      2.4      2.3     6.1
  141   7   2  -2  41.674  83.348  1.15851       90.8      7.8      7.2     6.1
  142   7   2   2  41.918  83.836  1.153        100.0      8.6      7.9     6.1
  143   3   6  -1  42.103  84.206  1.14887       15.2      1.3      1.2     6.1
  144   6   0  -3  42.328  84.655  1.14392       66.7      5.7      5.3     6.1
  145   2   1  -4  42.446  84.891  1.14134       16.4      1.4      1.3     6.1
  146   3   4   3  42.559  85.118  1.13888       17.4      1.5      1.4     6.1
  147   6   0   3  42.641  85.281  1.13712       60.6      5.2      4.8     6.1
  148   4   6   0  43.057  86.114  1.12824       18.0      1.5      1.4     6.1
  149   1   2  -4  43.2    86.399  1.12525       46.2      4.0      3.6     6.1
  150   1   2   4  43.269  86.538  1.1238        21.1      1.8      1.7     6.1
  151   0   6   2  43.536  87.072  1.11828       17.7      1.5      1.4     6.1
  152   5   3  -3  43.813  87.626  1.11263       18.2      1.6      1.4     6.2
  153   1   6  -2  43.867  87.734  1.11154       25.7      2.2      2.0     6.2
  154   1   6   2  43.902  87.803  1.11084       79.9      6.9      6.3     6.2
  155   5   3   3  44.073  88.146  1.1074        19.1      1.6      1.5     6.2
  156   3   1  -4  44.155  88.309  1.10578       25.1      2.2      2.0     6.2
  157   6   4  -2  44.22   88.439  1.10449       40.0      3.4      3.1     6.2
  158   3   1   4  44.362  88.725  1.10167       40.0      3.4      3.1     6.2
  159   6   4   2  44.427  88.855  1.10039       81.5      7.0      6.4     6.2
  160   8   0   2  44.813  89.627  1.09291       27.7      2.4      2.2     6.2
  161   1   5  -3  44.958  89.916  1.09014       79.5      6.8      6.2     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)