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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FAIRFIELDITE

4, t-fairfieldite, analogue

K(2)Mn[SeO(4)](2).2H(2)O


Triclinic  P 1(-)  Z = 1

P1(-)

24 .2 .14

Ref.Str.:

         Fleck M., Kolitsch U. (2003)

         * Z. Kristallogr., 218, 553-567

         R: In original - synthetic compounds with krohnkite-type chains.

         N.A.D.

                   Initial data from BDM-file 

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

             a =   5.674    alpha =  110.31
             b =   6.608    beta  =   95.69
             c =   7.523    gamma =  108.35

    Unit cell volume (cub. angs.) =   244.1 

    Molar volume ( cub.cm/mol.) =   147.03

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

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

   1 0.6835  0.3077  0.7433   0.0    K     = 1.00
   2 0.0     0.0     0.0      0.0    Mn    = 1.00
   3 0.655   0.322   0.2305   0.0    Se    = 1.00
   4 0.6153  0.1539  0.3481   0.0    O     = 1.00
   5 0.7511  0.5953  0.3763   0.0    O     = 1.00
   6 0.3879  0.2571  0.0784   0.0    O     = 1.00
   7 0.8685  0.2902  0.101    0.0    O     = 1.00
   8 0.9579  0.0074  0.7117   0.0    H(2)O = 1.00
   9 0.06    0.018   0.709    0.0    H     = 1.00
  10 0.897   0.911   0.651    0.0    H     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.6835     0.3077     0.7433
     2       2     0.0        0.0        0.0   
     3       3     0.655      0.322      0.2305
     4       4     0.6153     0.1539     0.3481
     5       5     0.7511     0.5953     0.3763
     6       6     0.3879     0.2571     0.0784
     7       7     0.8685     0.2902     0.101 
     8       8     0.9579     0.0074     0.7117
     9       9     0.06       0.018      0.709 
    10      10     0.897      0.911      0.651 
    11       1     0.3165     0.6923     0.2567
    12       3     0.345      0.678      0.7695
    13       4     0.3847     0.8461     0.6519
    14       5     0.2489     0.4047     0.6237
    15       6     0.6121     0.7429     0.9216
    16       7     0.1315     0.7098     0.899 
    17       8     0.0421     0.9926     0.2883
    18       9     0.94       0.982      0.291 
    19      10     0.103      0.089      0.349 


X-ray density (g/cm cub.)   =      3.12

MU (1/cm) =     293.519    Mass attenuation coefficient (cm**2/g) =     94.011

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

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

    1    K                   3.396        9
                                                 2.7295       4
                                                 3.2171       6
                                                 2.8439       7
                                                 2.8477       8
                                                 2.7764       4
                                                 3.3452       5
                                                 2.8736       5
                                                 2.8977       6
                                                 2.8088       7
    2    Mn                  2.892        6
                                                 2.1843       6
                                                 2.1939       7
                                                 2.1776       8
                                                 2.1843       6
                                                 2.1939       7
                                                 2.1776       8
    3    Se                  2.628        4
                                                 1.6223       4
                                                 1.6272       5
                                                 1.6421       6
                                                 1.647        7
    4    O                   3.432        6
                                                 2.6961       5
                                                 2.6911       6
                                                 2.6848       7
                                                 3.4028       6
                                                 2.9515       8
                                                 3.0184       8
    5    O                   3.432        5
                                                 2.6961       4
                                                 2.6403       6
                                                 2.6492       7
                                                 2.7911       8
                                                 2.9582       8
    6    O                   3.432        8
                                                 2.6911       4
                                                 2.6403       5
                                                 2.6494       7
                                                 3.04         7
                                                 3.0424       8
                                                 3.4028       4
                                                 3.1507       7
                                                 3.1256       8
    7    O                   3.432        7
                                                 2.6848       4
                                                 2.6492       5
                                                 3.04         6
                                                 2.6494       6
                                                 3.069        8
                                                 3.1507       6
                                                 3.113        8
    8    H(2)O               3.6          9
                                                 2.7911       5
                                                 3.0424       6
                                                 3.069        7
                                                 2.9515       4
                                                 3.0184       4
                                                 2.9582       5
                                                 3.1256       6
                                                 3.113        7
                                                 3.2401       8
    9    H                   1.8          1
                                                 0.5645       8
   10    H                   1.8          1
                                                 0.6016       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   0   0   1  6.448  12.896   0.073  155.62    2       30.2      475.8
    2   0   1   0  7.703  15.406   0.087  108.38    2        7.2       18.6
    3   0  -1   1  7.821  15.642   0.088  105.05    2       57.6     1171.0
    4   1   0   0  8.46   16.92    0.095   89.47    2       21.3      136.3
    5  -1   1   0  9.07   18.14    0.102   77.55    2       24.4      154.6
    6  -1   0   1  9.372  18.744   0.106   72.49    2       16.6       67.0
    7   1  -1   1 10.489  20.978   0.118   57.44    2       28.7      158.7
    8  -1   1   1 11.795  23.59    0.133   44.98    2       57.3      496.4
    9   1   0   1 11.825  23.649   0.133   44.75    2       50.6      384.9
   10   0   1   1 11.916  23.833   0.134   44.03    2       25.5       95.8
   11   0  -1   2 12.149  24.299   0.137   42.28    2       74.5      787.7
   12  -1  -1   1 12.546  25.092   0.141   39.52    2       20.9       58.1
   13   0   0   2 12.979  25.959   0.146   36.79    2       72.7      652.7
   14   1   1   0 13.484  26.968   0.151   33.94    2      115.0     1506.1
   15  -1   0   2 13.765  27.53    0.154   32.49    2       54.2      320.6
   16   1  -2   1 14.205  28.41    0.159   30.38    2       34.0      117.7
   17   0  -2   1 14.222  28.443   0.159   30.31    2       17.6       31.7
   18  -1   2   0 14.653  29.305   0.164   28.44    2      106.6     1085.6
   19  -1  -1   2 14.797  29.593   0.166   27.85    2       79.3      587.2
   20   1  -1   2 14.962  29.923   0.168   27.2     2       60.7      335.8
   21   0   2   0 15.549  31.099   0.174   25.04    2       45.3      172.6
   22   0  -2   2 15.793  31.586   0.177   24.21    2       12.7       13.1
   23  -2   1   0 15.897  31.793   0.178   23.87    2      110.3      974.1
   24   1  -2   2 16.606  33.211   0.186   21.72    2       63.9      297.4
   25  -2   0   1 16.818  33.636   0.188   21.13    2       53.5      202.8
   26  -1   1   2 16.841  33.682   0.188   21.07    2       59.8      253.1
   27  -2   1   1 16.87   33.74    0.188   20.99    2       17.8       22.4
   28   2   0   0 17.112  34.224   0.191   20.35    2       18.1       22.3
   29   1   1   1 17.132  34.264   0.191   20.3     2       27.9       53.2
   30   1   0   2 17.212  34.424   0.192   20.09    2       46.0      142.9
   31   2  -1   1 17.562  35.125   0.196   19.23    2        3.8        0.9
   32   0   1   2 17.709  35.418   0.197   18.88    2        5.0        1.6
   33  -1   2   1 17.754  35.507   0.198   18.78    2       38.8       94.9
   34   0  -1   3 17.98   35.961   0.2     18.26    2       37.9       88.1
   35  -2   2   0 18.378  36.755   0.205   17.41    2       14.8       12.7
   36   2  -2   1 18.754  37.509   0.209   16.65    2       10.5        6.2
   37  -1  -2   1 18.793  37.586   0.209   16.57    2       16.9       15.9
   38  -2   0   2 19.007  38.015   0.211   16.16    2       26.4       37.7
   39  -1  -1   3 19.23   38.461   0.214   15.75    2       13.6        9.8
   40   0   2   1 19.24   38.48    0.214   15.73    2        4.4        1.0
   41  -1  -2   2 19.348  38.696   0.215   15.54    2       49.0      125.4
   42  -1   0   3 19.546  39.092   0.217   15.19    2       26.9       36.8
   43   0  -2   3 19.644  39.288   0.218   15.02    2       60.6      185.1
   44   0   0   3 19.688  39.376   0.219   14.95    2       27.1       36.8
   45   2   0   1 19.793  39.585   0.22    14.77    2        7.7        3.0
   46  -2   1   2 20.147  40.295   0.224   14.2     2       75.9      274.9
   47  -2  -1   1 20.192  40.384   0.224   14.13    2       31.6       47.5
   48  -2   2   1 20.326  40.651   0.225   13.93    2       15.5       11.2
   49   1   2   0 20.533  41.066   0.228   13.61    2       22.9       23.9
   50   1  -3   1 20.551  41.102   0.228   13.59    2       17.5       13.9
   51   1  -1   3 20.738  41.476   0.23    13.31    2       44.3       87.7
   52   1  -2   3 20.993  41.986   0.233   12.96    2        5.0        1.1
   53  -2  -1   2 21.087  42.173   0.234   12.83    2       42.1       76.2
   54   2  -1   2 21.329  42.659   0.236   12.5     2       74.7      234.2
   55   2  -2   2 21.351  42.703   0.236   12.47    2       34.7       50.3
   56   1  -3   2 21.357  42.714   0.236   12.47    2       47.2       93.0
   57   2   1   0 21.478  42.956   0.238   12.31    2        2.1        0.2
   58   0  -3   1 21.817  43.635   0.241   11.88    2       17.2       11.8
   59  -1   3   0 21.895  43.789   0.242   11.79    2       29.0       33.4
   60   0  -3   2 21.955  43.91    0.243   11.72    2       66.6      174.3
   61  -1  -2   3 22.052  44.104   0.244   11.6     2       20.6       16.6
   62   1   1   2 22.334  44.668   0.247   11.27    2       65.7      163.2
   63  -1   2   2 22.56   45.121   0.249   11.02    2       59.1      129.3
   64  -1   1   3 22.892  45.784   0.253   10.66    2       14.5        7.6
   65   2  -3   1 22.916  45.832   0.253   10.64    2        8.9        2.8
   66  -2   0   3 23.078  46.157   0.254   10.47    2       20.0       14.1
   67   1   0   3 23.449  46.899   0.258   10.1     2       19.0       12.2
   68  -2   3   0 23.556  47.111   0.259    9.99    2        9.4        3.0
   69   0   3   0 23.71   47.42    0.261    9.85    2       95.6      301.8
   70  -2  -1   3 23.964  47.927   0.264    9.61    2       45.8       67.6
   71   0  -3   3 24.095  48.189   0.265    9.49    2       22.1       15.6
   72  -2   2   2 24.131  48.261   0.265    9.46    2       26.2       21.9
   73   1  -3   3 24.139  48.278   0.265    9.45    2       29.1       26.9
   74   1   2   1 24.158  48.316   0.266    9.44    2       15.0        7.1
   75   0   1   3 24.17   48.339   0.266    9.43    2       30.9       30.2
   76   2   0   2 24.195  48.389   0.266    9.41    2       57.4      104.0
   77  -3   1   0 24.234  48.468   0.266    9.37    2       11.7        4.3
   78   2  -3   2 24.255  48.509   0.267    9.35    2       44.6       62.5
   79  -3   1   1 24.346  48.691   0.268    9.27    2        5.0        0.8
   80   0   2   2 24.391  48.782   0.268    9.23    2       79.5      196.1
   81   0  -1   4 24.465  48.93    0.269    9.17    2        5.2        0.8
   82   2   1   1 24.669  49.338   0.271    9.0     2       22.8       15.7
   83  -1  -1   4 24.877  49.754   0.273    8.83    2       85.2      215.2
   84   0  -2   4 24.893  49.785   0.273    8.82    2        8.7        2.2
   85  -3   2   0 24.962  49.925   0.274    8.76    2       16.3        7.8
   86  -2   1   3 24.975  49.951   0.274    8.75    2       31.0       28.3
   87  -1   3   1 25.112  50.224   0.275    8.64    2       10.6        3.3
   88  -3   0   1 25.416  50.831   0.279    8.41    2        4.0        0.5
   89   2  -2   3 25.62   51.24    0.281    8.26    2        3.1        0.3
   90  -2  -2   2 25.75   51.499   0.282    8.16    2       37.5       38.5
   91   3  -2   1 25.828  51.656   0.283    8.11    2       22.3       13.5
   92  -1  -3   2 25.859  51.718   0.283    8.08    2       44.6       54.0
   93  -2  -2   1 25.878  51.756   0.283    8.07    2       15.1        6.2
   94  -3   2   1 25.96   51.92    0.284    8.01    2       50.5       68.6
   95   3  -1   1 26.006  52.011   0.285    7.98    2       34.7       32.3
   96  -1   0   4 26.022  52.045   0.285    7.97    2       12.7        4.3
   97  -2   3   1 26.062  52.124   0.285    7.94    2       42.1       47.3
   98   3   0   0 26.19   52.381   0.286    7.85    2       91.2      219.0
   99  -1  -3   1 26.3    52.599   0.288    7.78    2        0.2        0.0
  100  -3   1   2 26.323  52.645   0.288    7.76    2       47.2       58.0
  101  -1  -2   4 26.378  52.755   0.288    7.73    2       36.6       34.7
  102   2  -1   3 26.477  52.954   0.289    7.66    2       13.9        5.0
  103  -3   0   2 26.48   52.961   0.289    7.66    2       62.0       98.8
  104   1  -2   4 26.583  53.165   0.29     7.59    2       87.3      194.1
  105   0   0   4 26.692  53.384   0.292    7.52    2       57.7       84.2
  106   1  -1   4 27.228  54.457   0.297    7.19    2        4.1        0.4
  107  -1  -3   3 27.231  54.461   0.297    7.19    2       45.8       50.5
  108   0   3   1 27.308  54.616   0.298    7.14    2       38.0       34.6
  109   2  -3   3 27.352  54.705   0.298    7.11    2       70.3      118.1
  110  -2  -2   3 27.429  54.859   0.299    7.07    2       15.0        5.3
  111   2   2   0 27.797  55.594   0.303    6.86    2       71.7      118.3
  112   0  -3   4 27.887  55.774   0.304    6.81    2       73.9      124.8
  113   1  -4   2 27.938  55.876   0.304    6.78    2       53.1       64.1
  114   1  -4   1 28.122  56.244   0.306    6.68    2       28.1       17.7
  115   3  -3   1 28.2    56.399   0.307    6.64    2       28.4       18.0
  116  -3   3   0 28.224  56.448   0.307    6.62    2       60.0       80.1
  117  -2  -1   4 28.365  56.73    0.308    6.55    2        1.2        0.0
  118  -2   0   4 28.417  56.833   0.309    6.52    2       28.5       17.7
  119  -1   2   3 28.428  56.856   0.309    6.52    2        6.7        1.0
  120   3  -2   2 28.435  56.871   0.309    6.51    2       49.7       54.0
  121   1  -3   4 28.459  56.918   0.309    6.5     2       34.0       25.3
  122   1   1   3 28.471  56.942   0.309    6.5     2        2.7        0.2
  123   1   3   0 28.495  56.99    0.31     6.48    2       23.4       12.0
  124  -3   2   2 28.683  57.365   0.312    6.39    2       53.2       60.7
  125   3   0   1 28.7    57.4     0.312    6.38    2       24.6       13.0
  126  -3  -1   1 28.955  57.911   0.314    6.25    2       28.8       17.4
  127   2  -4   1 29.051  58.103   0.315    6.21    2       23.9       11.9
  128  -3  -1   2 29.128  58.257   0.316    6.17    2       43.1       38.5
  129   1   2   2 29.144  58.288   0.316    6.16    2       10.6        2.3
  130  -3   0   3 29.244  58.488   0.317    6.11    2       30.3       18.9
  131  -2   2   3 29.255  58.511   0.317    6.11    2       59.6       72.8
  132   2   1   2 29.305  58.61    0.318    6.09    2       73.8      111.4
  133   2  -4   2 29.393  58.785   0.319    6.04    2       38.1       29.4
  134   3  -1   2 29.416  58.833   0.319    6.03    2       37.2       28.1
  135   0  -4   2 29.429  58.859   0.319    6.03    2       41.9       35.5
  136   1  -4   3 29.472  58.944   0.319    6.01    2       55.3       61.7
  137  -1   1   4 29.596  59.192   0.321    5.95    2       25.0       12.5
  138  -1   3   2 29.76   59.519   0.322    5.88    2        1.3        0.0
  139   2   0   3 29.768  59.535   0.322    5.87    2       56.4       62.6
  140   3  -3   2 29.879  59.757   0.323    5.83    2       37.7       27.7
  141  -3   1   3 29.903  59.805   0.324    5.82    2       26.2       13.4
  142  -3   3   1 29.949  59.898   0.324    5.8     2       13.5        3.5
  143  -1   4   0 30.004  60.007   0.325    5.77    2       32.2       20.1
  144  -2   3   2 30.103  60.206   0.326    5.73    2       74.5      106.8
  145   0  -4   1 30.121  60.241   0.326    5.72    2       51.7       51.3
  146  -1  -3   4 30.247  60.494   0.327    5.67    2        3.1        0.2
  147   1   0   4 30.288  60.576   0.327    5.65    2       29.2       16.2
  148  -2   4   0 30.392  60.784   0.328    5.61    2       70.9       94.5
  149   0  -4   3 30.412  60.823   0.329    5.6     2        6.7        0.8
  150   3   1   0 30.463  60.927   0.329    5.58    2        7.6        1.1
  151   0   2   3 30.508  61.015   0.33     5.56    2        7.2        1.0
  152  -2  -2   4 30.715  61.431   0.332    5.48    2      105.8      206.0
  153  -2   1   4 30.862  61.724   0.333    5.42    2       78.8      113.0
  154  -3  -1   3 30.965  61.931   0.334    5.38    2        3.8        0.3
  155   0  -2   5 31.084  62.168   0.335    5.34    2       17.0        5.1
  156   2  -2   4 31.087  62.174   0.335    5.33    2       38.9       27.1
  157   0   1   4 31.176  62.352   0.336    5.3     2        5.7        0.6
  158   2   2   1 31.285  62.571   0.337    5.26    2       24.6       10.7
  159  -1  -1   5 31.35   62.7     0.338    5.24    2       18.8        6.2
  160   2  -4   3 31.382  62.764   0.338    5.22    2        7.1        0.9
  161   0  -1   5 31.497  62.993   0.339    5.18    2        7.8        1.1
  162   2  -3   4 31.864  63.728   0.343    5.05    2        7.4        0.9
  163  -1  -2   5 31.886  63.773   0.343    5.04    2       23.5        9.4
  164  -2  -3   2 32.201  64.401   0.346    4.94    2       19.2        6.1
  165   1   3   1 32.211  64.422   0.346    4.94    2       28.5       13.5
  166   0   3   2 32.233  64.467   0.346    4.93    2       38.2       24.1
  167   0   4   0 32.421  64.842   0.348    4.87    2       13.9        3.1
  168   3  -2   3 32.512  65.024   0.349    4.84    2       50.7       41.8
  169   1  -4   4 32.573  65.146   0.349    4.82    2       11.5        2.1
  170   2  -1   4 32.612  65.224   0.35     4.8     2       64.3       66.8
  171   3   0   2 32.687  65.375   0.351    4.78    2       45.8       33.7
  172   3  -4   1 32.754  65.509   0.351    4.76    2       11.8        2.2
  173  -3   2   3 32.855  65.71    0.352    4.73    2       17.2        4.7
  174  -2  -3   3 32.921  65.842   0.353    4.71    2        6.1        0.6
  175   0  -3   5 32.966  65.932   0.353    4.69    2       22.5        8.0
  176   0  -4   4 32.979  65.957   0.353    4.69    2        6.6        0.7
  177   1  -2   5 33.046  66.092   0.354    4.67    2       33.4       17.5
  178  -2  -3   1 33.072  66.144   0.354    4.66    2       23.1        8.4
  179  -1   0   5 33.101  66.202   0.354    4.65    2        2.1        0.1
  180   3  -3   3 33.102  66.204   0.355    4.65    2       17.0        4.5
  181  -4   1   1 33.145  66.291   0.355    4.64    2       69.6       75.5
  182  -3   3   2 33.213  66.425   0.356    4.62    2       56.6       49.6
  183  -4   2   0 33.217  66.433   0.356    4.62    2       91.7      130.4
  184  -2   4   1 33.293  66.587   0.356    4.6     2        0.3        0.0
  185  -1   4   1 33.408  66.817   0.357    4.56    2       32.7       16.4
  186  -3   0   4 33.444  66.888   0.358    4.55    2       77.9       92.8
  187   3   1   1 33.518  67.035   0.358    4.53    2       19.4        5.7
  188  -3   4   0 33.531  67.062   0.359    4.53    2       12.3        2.3
  189  -4   1   0 33.537  67.074   0.359    4.53    2       21.2        6.8
  190   3  -4   2 33.556  67.112   0.359    4.52    2       27.1       11.2
  191  -4   2   1 33.577  67.154   0.359    4.52    2        7.9        0.9
  192  -1  -4   2 33.624  67.248   0.359    4.5     2       60.9       56.1
  193  -3  -2   2 33.895  67.79    0.362    4.43    2       31.3       14.6
  194  -2  -1   5 33.937  67.874   0.362    4.42    2       26.9       10.7
  195   1  -3   5 33.966  67.932   0.363    4.41    2       17.5        4.5
  196  -1  -4   3 34.063  68.126   0.364    4.38    2       20.4        6.1
  197   0   0   5 34.159  68.319   0.364    4.36    2       18.6        5.1
  198   3  -1   3 34.169  68.339   0.365    4.35    2       19.4        5.5
  199  -3  -1   4 34.311  68.622   0.366    4.32    2       32.4       15.2
  200  -4   1   2 34.321  68.642   0.366    4.31    2       49.9       36.0
  201   1  -1   5 34.359  68.718   0.366    4.3     2        9.9        1.4
  202   4  -2   1 34.421  68.842   0.367    4.29    2       38.2       21.1
  203  -3  -2   1 34.48   68.96    0.367    4.27    2       13.2        2.5
  204  -1  -3   5 34.654  69.308   0.369    4.23    2       23.6        7.9
  205  -2   0   5 34.725  69.45    0.37     4.21    2        3.3        0.2
  206  -1  -4   1 34.742  69.484   0.37     4.21    2       19.9        5.6
  207  -3   1   4 34.796  69.593   0.37     4.19    2       16.9        4.0
  208   2  -4   4 34.86   69.719   0.371    4.18    2       81.1       92.3
  209  -3  -2   3 34.862  69.724   0.371    4.18    2       31.6       14.0
  210  -4   0   1 34.938  69.875   0.372    4.16    2        4.0        0.2
  211   2   1   3 35.071  70.142   0.373    4.13    2        8.6        1.0
  212  -4   3   0 35.115  70.231   0.373    4.12    2        4.4        0.3
  213  -1   2   4 35.14   70.28    0.374    4.11    2       79.8       87.8
  214  -2  -3   4 35.183  70.367   0.374    4.1     2       11.8        1.9
  215   1   2   3 35.188  70.377   0.374    4.1     2       55.9       43.0
  216  -2  -2   5 35.354  70.707   0.376    4.06    2       31.1       13.2
  217  -4   0   2 35.357  70.713   0.376    4.06    2       24.4        8.1
  218  -2   3   3 35.385  70.77    0.376    4.05    2       16.4        3.6
  219   1   1   4 35.385  70.771   0.376    4.05    2       75.0       76.6
  220  -2   2   4 35.411  70.823   0.376    4.05    2       23.2        7.3
  221   4  -1   1 35.471  70.941   0.377    4.04    2       31.3       13.3
  222   2   3   0 35.476  70.952   0.377    4.03    2        7.7        0.8
  223  -4   2   2 35.479  70.959   0.377    4.03    2       43.5       25.6
  224  -1   3   3 35.54   71.079   0.377    4.02    2       37.9       19.4
  225   4  -3   1 35.564  71.127   0.378    4.01    2       11.3        1.7
  226   1  -5   2 35.809  71.617   0.38     3.96    2       62.2       51.4
  227  -3   4   1 35.836  71.672   0.38     3.95    2        2.9        0.1
  228   3  -4   3 35.884  71.768   0.38     3.94    2       12.3        2.0
  229  -1  -4   4 36.032  72.064   0.382    3.91    2       74.7       73.3
  230   4   0   0 36.049  72.098   0.382    3.91    2       27.5        9.9
  231   2   2   2 36.097  72.193   0.382    3.9     2       62.3       50.8
  232   0   4   1 36.168  72.337   0.383    3.88    2        3.3        0.1
  233  -4   3   1 36.194  72.389   0.383    3.88    2        8.2        0.9
  234   2  -5   2 36.207  72.414   0.383    3.88    2       15.7        3.2
  235   2   0   4 36.286  72.572   0.384    3.86    2       18.8        4.6
  236   1  -5   3 36.44   72.881   0.386    3.83    2        7.7        0.8
  237   3   2   0 36.584  73.167   0.387    3.8     2       25.7        8.4
  238   2  -5   1 36.626  73.251   0.387    3.79    2       23.3        6.9
  239   1  -5   1 36.693  73.386   0.388    3.78    2       19.6        4.8
  240   0  -4   5 36.963  73.926   0.39     3.73    2        3.3        0.1
  241  -1   1   5 36.974  73.947   0.39     3.72    2       16.9        3.6
  242  -4   1   3 36.993  73.986   0.391    3.72    2        5.1        0.3
  243   1  -4   5 37.04   74.08    0.391    3.71    2       23.0        6.6
  244   4  -2   2 37.12   74.24    0.392    3.7     2       33.0       13.5
  245   1   3   2 37.22   74.44    0.393    3.68    2       60.5       45.2
  246  -4   0   3 37.285  74.569   0.393    3.67    2       26.5        8.6
  247   2  -5   3 37.297  74.593   0.393    3.67    2        9.3        1.1
  248  -3  -2   4 37.327  74.655   0.394    3.66    2        0.3        0.0
  249   1   4   0 37.354  74.707   0.394    3.66    2       77.7       74.2
  250   0   2   4 37.471  74.943   0.395    3.63    2       30.4       11.3
  251   4  -3   2 37.517  75.033   0.395    3.63    2       48.9       29.1
  252   2  -2   5 37.552  75.104   0.396    3.62    2        3.7        0.2
  253   2  -3   5 37.553  75.106   0.396    3.62    2       43.1       22.6
  254  -2   4   2 37.579  75.157   0.396    3.62    2       49.3       29.6
  255  -2   1   5 37.656  75.313   0.397    3.6     2       31.0       11.6
  256   3  -3   4 37.677  75.353   0.397    3.6     2       69.9       59.0
  257   1   0   5 37.797  75.594   0.398    3.58    2        6.3        0.5
  258  -3   3   3 37.823  75.646   0.398    3.57    2        4.7        0.3
  259   3  -2   4 37.836  75.671   0.398    3.57    2        2.9        0.1
  260   3   0   3 37.934  75.868   0.399    3.55    2        6.5        0.5
  261   3   1   2 37.94   75.879   0.399    3.55    2       13.4        2.1
  262   0  -5   2 37.997  75.995   0.4      3.54    2       59.6       42.2
  263   0  -2   6 38.125  76.251   0.401    3.52    2       39.3       18.3
  264  -1   4   2 38.145  76.289   0.401    3.52    2       46.4       25.5
  265   0  -5   3 38.161  76.321   0.401    3.52    2       56.7       38.0
  266  -3   2   4 38.264  76.527   0.402    3.5     2       40.7       19.5
  267   0   3   3 38.276  76.551   0.402    3.5     2       13.4        2.1
  268  -1  -2   6 38.405  76.809   0.403    3.48    2       53.0       32.8
  269  -4  -1   2 38.513  77.025   0.404    3.46    2       48.9       27.8
  270  -2   5   0 38.535  77.07    0.404    3.46    2        5.1        0.3
  271   1  -5   4 38.56   77.12    0.405    3.45    2       62.0       44.6
  272  -1  -1   6 38.622  77.244   0.405    3.45    2       40.1       18.6
  273   4   0   1 38.637  77.274   0.405    3.44    2        0.5        0.0
  274  -4   3   2 38.75   77.5     0.406    3.43    2        4.4        0.2
  275  -4  -1   1 38.816  77.632   0.407    3.42    2        1.9        0.0
  276   4  -4   1 38.817  77.635   0.407    3.42    2       30.7       10.8
  277  -4   2   3 38.828  77.655   0.407    3.41    2       15.5        2.8
  278   4  -1   2 38.848  77.696   0.407    3.41    2       29.8       10.1
  279   0   1   5 38.853  77.706   0.407    3.41    2       15.9        2.9
  280  -2  -3   5 38.872  77.743   0.407    3.41    2       27.3        8.5
  281  -3   0   5 38.882  77.763   0.407    3.41    2       21.0        5.0
  282  -3  -1   5 38.996  77.992   0.408    3.39    2       29.8       10.1
  283  -1   5   0 39.055  78.11    0.409    3.38    2       70.0       55.7
  284  -4   4   0 39.091  78.183   0.409    3.38    2       32.0       11.6
  285   3  -5   1 39.119  78.238   0.41     3.37    2       30.0       10.2
  286   0  -3   6 39.152  78.304   0.41     3.37    2       51.2       29.7
  287   3  -5   2 39.163  78.326   0.41     3.37    2       54.2       33.2
  288   0  -1   6 39.209  78.418   0.41     3.36    2       59.9       40.4
  289   2   3   1 39.294  78.589   0.411    3.35    2       13.9        2.2
  290   0  -5   1 39.317  78.633   0.411    3.34    2       24.9        7.0
  291  -1  -4   5 39.439  78.879   0.412    3.33    2       16.3        3.0
  292  -3   4   2 39.56   79.12    0.413    3.31    2       10.4        1.2
  293   3  -4   4 39.63   79.26    0.414    3.3     2       26.5        7.8
  294   2  -1   5 39.662  79.325   0.414    3.3     2       48.1       25.7
  295   2  -4   5 39.665  79.331   0.414    3.3     2       45.9       23.3
  296  -4  -1   3 39.686  79.372   0.415    3.29    2        4.7        0.2
  297   0  -5   4 39.8    79.601   0.416    3.28    2       15.4        2.6
  298   2  -5   4 39.852  79.703   0.416    3.27    2        0.7        0.0
  299   4  -4   2 40.018  80.035   0.417    3.25    2       23.3        5.9
  300  -2  -4   3 40.075  80.151   0.418    3.25    2       25.4        7.0
  301   3  -1   4 40.098  80.197   0.418    3.24    2       19.8        4.3
  302  -2  -4   2 40.113  80.227   0.418    3.24    2       47.4       24.4
  303   3   2   1 40.115  80.229   0.418    3.24    2        8.2        0.7
  304  -1  -3   6 40.289  80.577   0.42     3.22    2       31.2       10.5
  305   1  -2   6 40.38   80.759   0.421    3.21    2       35.0       13.2
  306  -3  -3   2 40.454  80.908   0.421    3.2     2       54.3       31.6
  307   1  -3   6 40.537  81.075   0.422    3.19    2       52.8       29.9
  308  -3   5   0 40.544  81.088   0.422    3.19    2       14.3        2.2
  309  -2  -1   6 40.563  81.126   0.422    3.19    2        4.4        0.2
  310   4   1   0 40.588  81.176   0.422    3.18    2       61.3       40.2
  311  -4   0   4 40.646  81.291   0.423    3.18    2       12.1        1.6
  312  -3  -3   3 40.667  81.334   0.423    3.18    2       19.3        4.0
  313   3  -5   3 40.675  81.35    0.423    3.17    2       51.4       28.1
  314  -4   4   1 40.832  81.663   0.424    3.16    2       38.1       15.4
  315  -3   1   5 40.861  81.721   0.425    3.15    2        7.3        0.6
  316   4  -3   3 40.901  81.802   0.425    3.15    2       26.4        7.4
  317  -1   0   6 40.931  81.863   0.425    3.15    2        1.2        0.0
  318  -4   1   4 41.06   82.121   0.426    3.13    2       10.2        1.1
  319  -3  -2   5 41.199  82.398   0.428    3.12    2       23.5        5.8
  320  -2  -2   6 41.204  82.407   0.428    3.12    2       52.3       28.6
  321   4  -2   3 41.212  82.424   0.428    3.12    2        3.8        0.1
  322   0   4   2 41.228  82.456   0.428    3.11    2        2.8        0.1
  323   1   4   1 41.364  82.728   0.429    3.1     2        5.3        0.3
  324  -2  -4   4 41.499  82.998   0.43     3.09    2       33.9       11.9
  325  -2  -4   1 41.611  83.223   0.431    3.08    2       12.3        1.6
  326  -3  -3   1 41.7    83.401   0.432    3.07    2        6.7        0.5
  327  -2   3   4 41.802  83.603   0.433    3.06    2       43.8       19.6
  328  -2   5   1 41.874  83.748   0.433    3.05    2        1.7        0.0
  329   2   1   4 41.898  83.796   0.433    3.05    2       44.9       20.6
  330  -2   0   6 42.0    84.0     0.434    3.04    2       62.7       40.0
  331   0   5   0 42.081  84.161   0.435    3.03    2       29.2        8.7
  332   1  -5   5 42.101  84.202   0.435    3.03    2       20.8        4.4
  333   2   2   3 42.116  84.231   0.435    3.03    2       13.8        1.9
  334   0  -4   6 42.248  84.497   0.436    3.02    2       33.2       11.1
  335   1   2   4 42.258  84.516   0.437    3.02    2       15.4        2.4
  336   1  -1   6 42.299  84.597   0.437    3.01    2        2.0        0.0
  337  -4  -1   4 42.307  84.613   0.437    3.01    2       66.6       44.9
  338  -3  -3   4 42.335  84.67    0.437    3.01    2       72.0       52.4
  339  -1  -5   3 42.36   84.72    0.437    3.01    2        7.0        0.5
  340   0   0   6 42.361  84.722   0.437    3.01    2       38.9       15.3
  341  -1   3   4 42.394  84.789   0.438    3.0     2       12.9        1.7
  342  -2   2   5 42.585  85.17    0.439    2.99    2       13.1        1.7
  343   4   0   2 42.628  85.255   0.44     2.98    2       46.3       21.5
  344  -1  -5   2 42.646  85.292   0.44     2.98    2       19.4        3.8
  345   4  -4   3 42.662  85.325   0.44     2.98    2       51.9       26.9
  346  -4   3   3 42.71   85.419   0.44     2.98    2       32.7       10.7
  347   1  -4   6 42.768  85.535   0.441    2.97    2       30.1        9.0
  348  -1   2   5 42.773  85.545   0.441    2.97    2        8.2        0.7
  349  -1   5   1 42.829  85.659   0.441    2.97    2        6.1        0.4
  350   0  -5   5 42.876  85.751   0.442    2.96    2        2.4        0.1
  351  -5   2   1 42.902  85.804   0.442    2.96    2        5.2        0.3
  352  -5   2   0 43.014  86.028   0.443    2.95    2       15.7        2.5
  353  -2   4   3 43.15   86.3     0.444    2.94    2        3.3        0.1
  354   1   1   5 43.201  86.402   0.444    2.94    2       24.5        5.9
  355  -5   1   1 43.352  86.704   0.446    2.93    2        4.5        0.2
  356  -3   5   1 43.409  86.817   0.446    2.92    2       53.2       27.8
  357   1   3   3 43.443  86.887   0.446    2.92    2       12.7        1.6
  358   3  -3   5 43.516  87.032   0.447    2.92    2       40.0       15.7
  359  -1  -5   4 43.523  87.047   0.447    2.92    2        2.3        0.1
  360  -4   2   4 43.541  87.082   0.447    2.91    2       54.0       28.6
  361   4  -1   3 43.59   87.18    0.448    2.91    2       23.7        5.5
  362   3  -5   4 43.624  87.249   0.448    2.91    2       21.6        4.5
  363   3   1   3 43.644  87.288   0.448    2.91    2       46.6       21.2
  364  -4  -2   2 43.656  87.312   0.448    2.91    2       38.1       14.1
  365  -3   3   4 43.698  87.397   0.448    2.9     2       71.5       49.8
  366   4   1   1 43.792  87.584   0.449    2.9     2       45.8       20.4
  367   2   0   5 43.809  87.618   0.449    2.9     2        9.5        0.9
  368   2  -5   5 43.814  87.628   0.449    2.9     2       13.2        1.7
  369  -2  -3   6 43.907  87.814   0.45     2.89    2       56.8       31.3
  370  -5   3   0 43.934  87.868   0.45     2.89    2       20.2        3.9
  371  -5   1   2 43.995  87.99    0.451    2.88    2       46.4       20.8
  372  -4   4   2 44.004  88.008   0.451    2.88    2       57.2       31.7
  373   4  -5   1 44.056  88.112   0.451    2.88    2       26.2        6.6
  374  -4  -2   3 44.114  88.229   0.452    2.88    2        2.9        0.1
  375  -1   4   3 44.143  88.286   0.452    2.88    2        4.4        0.2
  376  -5   1   0 44.156  88.312   0.452    2.87    2       70.7       48.2
  377  -1  -4   6 44.215  88.431   0.453    2.87    2       32.7       10.3
  378  -5   2   2 44.237  88.473   0.453    2.87    2       19.7        3.8
  379  -2  -4   5 44.36   88.721   0.454    2.86    2       13.0        1.6
  380   3  -2   5 44.361  88.722   0.454    2.86    2       14.6        2.1
  381  -1  -5   1 44.379  88.757   0.454    2.86    2       26.5        6.7
  382   3   3   0 44.388  88.775   0.454    2.86    2       68.2       44.7
  383   3   0   4 44.393  88.787   0.454    2.86    2       55.9       30.1
  384   2  -3   6 44.399  88.797   0.454    2.86    2       21.6        4.5
  385   2   3   2 44.459  88.918   0.455    2.86    2        9.3        0.8
  386  -5   3   1 44.513  89.026   0.455    2.85    2       43.9       18.5
  387   4  -5   2 44.542  89.085   0.455    2.85    2       37.5       13.5
  388   2   4   0 44.547  89.094   0.455    2.85    2       14.6        2.0
  389   5  -2   1 44.573  89.146   0.456    2.85    2       19.6        3.7
  390   2  -6   2 44.594  89.188   0.456    2.85    2       46.7       20.9
  391  -3   4   3 44.639  89.278   0.456    2.85    2       40.8       15.9
  392  -4  -2   1 44.644  89.287   0.456    2.85    2       43.8       18.3
  393   3  -4   5 44.731  89.461   0.457    2.84    2       12.0        1.4
  394   5  -3   1 44.801  89.601   0.457    2.84    2       29.8        8.5
  395  -3   2   5 44.881  89.761   0.458    2.83    2       21.6        4.4
  396   2  -6   3 44.948  89.896   0.459    2.83    2       44.1       18.5
  397  -3  -1   6 44.967  89.934   0.459    2.83    2       54.6       28.3
  398   1  -6   3 44.972  89.943   0.459    2.83    2        1.0        0.0


  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   0   0   1   6.448  12.896  6.85916      475.8     31.6     31.9     5.6
    2   0   1   0   7.703  15.406  5.74686       18.6      1.2      1.2     5.6
    3   0  -1   1   7.821  15.642  5.66042     1171.0     77.7     78.4     5.6
    4   1   0   0   8.46   16.92   5.23578      136.3      9.0      9.1     5.6
    5  -1   1   0   9.07   18.14   4.88633      154.6     10.3     10.3     5.6
    6  -1   0   1   9.372  18.744  4.73016       67.0      4.5      4.5     5.6
    7   1  -1   1  10.489  20.978  4.23129      158.7     10.5     10.6     5.6
    8  -1   1   1  11.795  23.59   3.76832      496.4     33.0     33.0     5.6
    9   1   0   1  11.825  23.649  3.75895      384.9     25.6     25.6     5.6
   10   0   1   1  11.916  23.833  3.73049       95.8      6.4      6.4     5.6
   11   0  -1   2  12.149  24.299  3.65998      787.7     52.3     52.4     5.6
   12  -1  -1   1  12.546  25.092  3.54609       58.1      3.9      3.9     5.6
   13   0   0   2  12.979  25.959  3.42958      652.7     43.3     43.4     5.6
   14   1   1   0  13.484  26.968  3.30352     1506.1    100.0    100.0     5.6
   15  -1   0   2  13.765  27.53   3.2373       320.6     21.3     21.3     5.6
   16   1  -2   1  14.205  28.41   3.13894      149.3      9.9      9.9     5.6
   17  -1   2   0  14.653  29.305  3.0451      1085.6     72.1     71.9     5.6
   18  -1  -1   2  14.797  29.593  3.01612      587.2     39.0     38.9     5.6
   19   1  -1   2  14.962  29.923  2.98361      335.8     22.3     22.2     5.6
   20   0   2   0  15.549  31.099  2.87343      172.6     11.5     11.4     5.6
   21  -2   1   0  15.897  31.793  2.81223      974.1     64.7     64.4     5.6
   22   1  -2   2  16.606  33.211  2.69532      297.4     19.7     19.6     5.6
   23  -1   1   2  16.841  33.682  2.6587       456.0     30.3     30.1     5.7
   24  -2   1   1  16.87   33.74   2.65426       22.4      1.5      1.5     5.7
   25   1   1   1  17.132  34.264  2.61489       75.5      5.0      5.0     5.7
   26   1   0   2  17.212  34.424  2.6031       142.9      9.5      9.4     5.7
   27  -1   2   1  17.754  35.507  2.52614       94.9      6.3      6.3     5.7
   28   0  -1   3  17.98   35.961  2.4953        88.1      5.8      5.8     5.7
   29  -1  -2   1  18.793  37.586  2.39106       15.9      1.1      1.0     5.7
   30  -2   0   2  19.007  38.015  2.36508       37.7      2.5      2.5     5.7
   31  -1  -2   2  19.348  38.696  2.32501      125.4      8.3      8.2     5.7
   32  -1   0   3  19.546  39.092  2.30233       36.8      2.4      2.4     5.7
   33   0  -2   3  19.644  39.288  2.29132      185.1     12.3     12.2     5.7
   34   0   0   3  19.688  39.376  2.28639       36.8      2.4      2.4     5.7
   35  -2   1   2  20.147  40.295  2.23634      274.9     18.3     18.0     5.7
   36  -2  -1   1  20.192  40.384  2.23164       47.5      3.2      3.1     5.7
   37   1   2   0  20.533  41.066  2.19612       37.8      2.5      2.5     5.7
   38   1  -1   3  20.738  41.476  2.17532       87.7      5.8      5.7     5.7
   39  -2  -1   2  21.087  42.173  2.14099       76.2      5.1      5.0     5.7
   40   2  -1   2  21.329  42.659  2.11774      377.5     25.1     24.7     5.7
   41  -1   3   0  21.895  43.789  2.06564       33.4      2.2      2.2     5.7
   42   0  -3   2  21.955  43.91   2.06026      174.3     11.6     11.4     5.7
   43  -1  -2   3  22.052  44.104  2.05161       16.6      1.1      1.1     5.7
   44   1   1   2  22.334  44.668  2.02703      163.2     10.8     10.7     5.7
   45  -1   2   2  22.56   45.121  2.00774      129.3      8.6      8.4     5.7
   46   0   3   0  23.71   47.42   1.91562      301.8     20.0     19.7     5.7
   47  -2  -1   3  23.964  47.927  1.89651       67.6      4.5      4.4     5.7
   48   0  -3   3  24.095  48.189  1.88681       15.6      1.0      1.0     5.7
   49   1  -3   3  24.139  48.278  1.88355       55.9      3.7      3.6     5.7
   50   2   0   2  24.195  48.389  1.87948      134.2      8.9      8.7     5.7
   51   2  -3   2  24.255  48.509  1.8751        66.8      4.4      4.3     5.7
   52   0   2   2  24.391  48.782  1.86525      196.1     13.0     12.8     5.7
   53   2   1   1  24.669  49.338  1.84554       15.7      1.0      1.0     5.7
   54  -1  -1   4  24.877  49.754  1.83106      217.4     14.4     14.1     5.7
   55  -2   1   3  24.975  49.951  1.82431       36.1      2.4      2.3     5.7
   56  -2  -2   2  25.75   51.499  1.77305       38.5      2.6      2.5     5.8
   57  -1  -3   2  25.859  51.718  1.76607       60.2      4.0      3.9     5.8
   58  -3   2   1  25.96   51.92   1.75966       68.6      4.6      4.4     5.8
   59   3  -1   1  26.006  52.011  1.75679       36.6      2.4      2.4     5.8
   60  -2   3   1  26.062  52.124  1.75325       47.3      3.1      3.1     5.8
   61   3   0   0  26.19   52.381  1.74526      219.0     14.5     14.2     5.8
   62  -3   1   2  26.323  52.645  1.73712       58.0      3.8      3.7     5.8
   63  -1  -2   4  26.378  52.755  1.73375       34.7      2.3      2.2     5.8
   64  -3   0   2  26.48   52.961  1.72751      103.7      6.9      6.7     5.8
   65   1  -2   4  26.583  53.165  1.72134      194.1     12.9     12.6     5.8
   66   0   0   4  26.692  53.384  1.71479       84.2      5.6      5.4     5.8
   67  -1  -3   3  27.231  54.461  1.6834        50.5      3.4      3.3     5.8
   68   0   3   1  27.308  54.616  1.67899       34.6      2.3      2.2     5.8
   69   2  -3   3  27.352  54.705  1.67648      118.1      7.8      7.6     5.8
   70   2   2   0  27.797  55.594  1.65176      118.3      7.9      7.6     5.8
   71   0  -3   4  27.887  55.774  1.64686      124.8      8.3      8.0     5.8
   72   1  -4   2  27.938  55.876  1.64409       64.1      4.3      4.1     5.8
   73   1  -4   1  28.122  56.244  1.63421       17.7      1.2      1.1     5.8
   74  -3   3   0  28.224  56.448  1.62878       98.1      6.5      6.3     5.8
   75   3  -2   2  28.435  56.871  1.61767       98.1      6.5      6.3     5.8
   76  -3   2   2  28.683  57.365  1.60489       73.7      4.9      4.7     5.8
   77  -3  -1   1  28.955  57.911  1.59107       17.4      1.2      1.1     5.8
   78  -3  -1   2  29.128  58.257  1.58243       40.8      2.7      2.6     5.8
   79  -2   2   3  29.255  58.511  1.57617       91.7      6.1      5.9     5.8
   80   2   1   2  29.305  58.61   1.57375      111.4      7.4      7.1     5.8
   81   2  -4   2  29.393  58.785  1.56947       57.5      3.8      3.7     5.8
   82   0  -4   2  29.429  58.859  1.56768       35.5      2.4      2.3     5.8
   83   1  -4   3  29.472  58.944  1.56561       61.7      4.1      4.0     5.8
   84   2   0   3  29.768  59.535  1.55147       62.6      4.2      4.0     5.8
   85   3  -3   2  29.879  59.757  1.54624       41.1      2.7      2.6     5.8
   86  -1   4   0  30.004  60.007  1.54039       20.1      1.3      1.3     5.8
   87  -2   3   2  30.103  60.206  1.53578      158.0     10.5     10.1     5.8
   88   1   0   4  30.288  60.576  1.52727       16.2      1.1      1.0     5.8
   89  -2   4   0  30.392  60.784  1.52255       95.4      6.3      6.1     5.8
   90  -2  -2   4  30.715  61.431  1.50806      206.0     13.7     13.2     5.8
   91  -2   1   4  30.862  61.724  1.5016       113.0      7.5      7.2     5.8
   92   2  -2   4  31.087  62.174  1.49181       32.2      2.1      2.1     5.8
   93   0   3   2  32.233  64.467  1.44418       43.7      2.9      2.8     5.9
   94   3  -2   3  32.512  65.024  1.43313       41.8      2.8      2.7     5.9
   95   2  -1   4  32.612  65.224  1.42924       66.8      4.4      4.2     5.9
   96   3   0   2  32.687  65.375  1.4263        33.7      2.2      2.1     5.9
   97   1  -2   5  33.046  66.092  1.41254       25.8      1.7      1.6     5.9
   98  -4   1   1  33.145  66.291  1.40879       75.5      5.0      4.8     5.9
   99  -4   2   0  33.217  66.433  1.40612      180.0     12.0     11.4     5.9
  100  -1   4   1  33.408  66.817  1.39898       16.4      1.1      1.0     5.9
  101  -3   0   4  33.444  66.888  1.39766       92.8      6.2      5.9     5.9
  102  -4   1   0  33.537  67.074  1.39423       27.0      1.8      1.7     5.9
  103  -1  -4   2  33.624  67.248  1.39104       56.1      3.7      3.6     5.9
  104  -2  -1   5  33.937  67.874  1.37973       15.2      1.0      1.0     5.9
  105  -4   1   2  34.321  68.642  1.36617       51.2      3.4      3.2     5.9
  106   4  -2   1  34.421  68.842  1.36267       21.1      1.4      1.3     5.9
  107   2  -4   4  34.86   69.719  1.34766      106.3      7.1      6.7     5.9
  108  -1   2   4  35.14   70.28   1.33828       87.8      5.8      5.5     5.9
  109   1   2   3  35.188  70.377  1.33667       44.9      3.0      2.8     5.9
  110  -2  -2   5  35.354  70.707  1.33124       21.3      1.4      1.3     5.9
  111  -2   2   4  35.411  70.823  1.32935       87.6      5.8      5.5     5.9
  112  -4   2   2  35.479  70.959  1.32713       39.7      2.6      2.5     5.9
  113  -1   3   3  35.54   71.079  1.32518       21.1      1.4      1.3     5.9
  114   1  -5   2  35.809  71.617  1.31654       51.5      3.4      3.2     5.9
  115  -1  -4   4  36.032  72.064  1.30947       83.2      5.5      5.2     5.9
  116   2   2   2  36.097  72.193  1.30744       50.8      3.4      3.2     5.9
  117   1   3   2  37.22   74.44   1.27345       45.2      3.0      2.8     6.0
  118   1   4   0  37.354  74.707  1.26955       74.2      4.9      4.6     6.0
  119   4  -3   2  37.517  75.033  1.26484       29.1      1.9      1.8     6.0
  120  -2   4   2  37.579  75.157  1.26307       52.2      3.5      3.3     6.0
  121   3  -3   4  37.677  75.353  1.26026       70.6      4.7      4.4     6.0
  122   0  -5   2  37.997  75.995  1.25121       42.2      2.8      2.6     6.0
  123  -1   4   2  38.145  76.289  1.24711       81.7      5.4      5.1     6.0
  124  -3   2   4  38.264  76.527  1.24383       21.6      1.4      1.3     6.0
  125  -1  -2   6  38.405  76.809  1.23996       32.8      2.2      2.0     6.0
  126  -4  -1   2  38.513  77.025  1.23703       28.1      1.9      1.7     6.0
  127   1  -5   4  38.56   77.12   1.23575       44.6      3.0      2.8     6.0
  128  -1  -1   6  38.622  77.244  1.23407       18.6      1.2      1.2     6.0
  129   4  -1   2  38.848  77.696  1.22801       21.6      1.4      1.3     6.0
  130  -1   5   0  39.055  78.11   1.22254       55.7      3.7      3.5     6.0
  131  -4   4   0  39.091  78.183  1.22158       21.7      1.4      1.3     6.0
  132   3  -5   2  39.163  78.326  1.21971       62.9      4.2      3.9     6.0
  133   0  -1   6  39.209  78.418  1.2185        40.4      2.7      2.5     6.0
  134   2  -1   5  39.662  79.325  1.20684       49.2      3.3      3.0     6.0
  135  -2  -4   2  40.113  80.227  1.19553       25.2      1.7      1.6     6.0
  136  -3  -3   2  40.454  80.908  1.18717       31.6      2.1      1.9     6.1
  137   1  -3   6  40.537  81.075  1.18515       32.3      2.1      2.0     6.1
  138   4   1   0  40.588  81.176  1.18392       40.2      2.7      2.5     6.1
  139   3  -5   3  40.675  81.35   1.18183       33.7      2.2      2.1     6.1
  140  -4   4   1  40.832  81.663  1.17809       16.0      1.1      1.0     6.1
  141  -2  -2   6  41.204  82.407  1.16933       34.6      2.3      2.1     6.1
  142  -2   3   4  41.802  83.603  1.15561       19.6      1.3      1.2     6.1
  143   2   1   4  41.898  83.796  1.15345       20.6      1.4      1.3     6.1
  144  -2   0   6  42.0    84.0    1.15116       40.0      2.7      2.4     6.1
  145  -3  -3   4  42.335  84.67   1.14376      112.5      7.5      6.9     6.1
  146   4   0   2  42.628  85.255  1.1374        25.2      1.7      1.5     6.1
  147   4  -4   3  42.662  85.325  1.13665       26.9      1.8      1.6     6.1
  148  -3   5   1  43.409  86.817  1.1209        27.8      1.8      1.7     6.1
  149  -4   2   4  43.541  87.082  1.11817       44.3      2.9      2.7     6.1
  150   3   1   3  43.644  87.288  1.11606       39.9      2.6      2.4     6.2
  151  -3   3   4  43.698  87.397  1.11495       49.8      3.3      3.0     6.2
  152   4   1   1  43.792  87.584  1.11306       22.9      1.5      1.4     6.2
  153  -2  -3   6  43.907  87.814  1.11073       35.2      2.3      2.1     6.2
  154  -4   4   2  44.004  88.008  1.10878       52.5      3.5      3.2     6.2
  155  -5   1   0  44.156  88.312  1.10575       48.2      3.2      2.9     6.2
  156   3   3   0  44.388  88.775  1.10117       89.7      6.0      5.4     6.2
  157  -5   3   1  44.513  89.026  1.09872       31.9      2.1      1.9     6.2
  158   2  -6   2  44.594  89.188  1.09714       26.6      1.8      1.6     6.2
  159  -4  -2   1  44.644  89.287  1.09618       34.3      2.3      2.1     6.2
  160  -3  -1   6  44.967  89.934  1.08996       46.8      3.1      2.8     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)