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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JASKOLSKIITE

1, f-meneghinite, DN

Cu(0.2)Pb(2.2)Sb(1.2)Bi(0.6)S(5)


Orthorhombic  P bnm  Z = 4

R =0.072          NR =472

1 .2 .1989

Ref.Str.:

         E. Makovsky, R. Norrestam (1985)

         * Z. Kristallogr., 171, 179-194

                   Initial data from BDM-file 

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

             a =  11.312    alpha =   90.0 
             b =  19.829    beta  =   90.0 
             c =   4.088    gamma =   90.0 

    Unit cell volume (cub. angs.) =   916.96

    Molar volume ( cub.cm/mol.) =   138.08

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

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

   1 0.3014  0.9763  0.25     0.0    Sb    = 0.71, Pb    = 0.29
   2 0.3753  0.1281  0.75     0.0    Sb    = 0.6 , Bi    = 0.4 
   3 0.4991  0.4043  0.75     0.0    Bi    = 0.2 , Pb    = 0.8 
   4 0.1688  0.2923  0.75     0.0    Pb    = 1.00
   5 0.3915  0.2587  0.25     0.0    Cu    = 0.16, Cu    = 0.0 
   6 0.6285  0.4764  0.25     0.0    S     = 1.00
   7 0.5632  0.0793  0.25     0.0    S     = 1.00
   8 0.2467  0.1711  0.25     0.0    S     = 1.00
   9 0.4948  0.2335  0.75     0.0    S     = 1.00
  10 0.3184  0.368   0.25     0.0    S     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.3014     0.9763     0.25  
     2       2     0.3753     0.1281     0.75  
     3       3     0.4991     0.4043     0.75  
     4       4     0.1688     0.2923     0.75  
     5       5     0.3915     0.2587     0.25  
     6       6     0.6285     0.4764     0.25  
     7       7     0.5632     0.0793     0.25  
     8       8     0.2467     0.1711     0.25  
     9       9     0.4948     0.2335     0.75  
    10      10     0.3184     0.368      0.25  
    11       1     0.6986     0.0237     0.75  
    12       2     0.6247     0.8719     0.25  
    13       3     0.5009     0.5957     0.25  
    14       4     0.8312     0.7077     0.25  
    15       5     0.6085     0.7413     0.75  
    16       6     0.3715     0.5236     0.75  
    17       7     0.4368     0.9207     0.75  
    18       8     0.7533     0.8289     0.75  
    19       9     0.5052     0.7665     0.25  
    20      10     0.6816     0.632      0.75  
    21       1     0.1986     0.4763     0.25  
    22       2     0.1247     0.6281     0.75  
    23       3     0.0009     0.9043     0.75  
    24       4     0.3312     0.7923     0.75  
    25       5     0.1085     0.7587     0.25  
    26       6     0.8715     0.9764     0.25  
    27       7     0.9368     0.5793     0.25  
    28       8     0.2533     0.6711     0.25  
    29       9     0.0052     0.7335     0.75  
    30      10     0.1816     0.868      0.25  
    31       1     0.8014     0.5237     0.75  
    32       2     0.8753     0.3719     0.25  
    33       3     0.9991     0.0957     0.25  
    34       4     0.6688     0.2077     0.25  
    35       5     0.8915     0.2413     0.75  
    36       6     0.1285     0.0236     0.75  
    37       7     0.0632     0.4207     0.75  
    38       8     0.7467     0.3289     0.75  
    39       9     0.9948     0.2665     0.25  
    40      10     0.8184     0.132      0.75  


X-ray density (g/cm cub.)   =      6.43

MU (1/cm) =    1364.58     Mass attenuation coefficient (cm**2/g) =    212.117

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

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

    1   Sb   ,Pb             3.696        6
                                                 3.5975       7
                                                 2.782        7
                                                 2.782        7
                                                 2.5393      10
                                                 2.9804       6
                                                 2.9804       6
    2   Sb   ,Bi             3.624        6
                                                 3.1036       7
                                                 3.1036       7
                                                 2.6497       8
                                                 2.6497       8
                                                 2.489        9
                                                 3.4768       6
    3   Bi   ,Pb             3.696        7
                                                 2.8921       6
                                                 2.8921       6
                                                 3.3871       9
                                                 2.979       10
                                                 2.979       10
                                                 2.7712       6
                                                 3.1749       8
    4    Pb                  3.696        7
                                                 3.2757       8
                                                 3.2757       8
                                                 3.0488      10
                                                 3.0488      10
                                                 2.8123       7
                                                 2.8834       9
                                                 2.8834       9
    5   Cu   ,Cu             3.36         4
                                                 2.3875       8
                                                 2.4069       9
                                                 2.4069       9
                                                 2.3197      10
    6    S                   4.368       10
                                                 4.088        6
                                                 4.088        6
                                                 4.114       10
                                                 3.675        6
                                                 3.675        6
                                                 3.7495      10
                                                 3.7495      10
                                                 4.0405       7
                                                 3.8105       8
                                                 3.8105       8
    7    S                   4.368       10
                                                 4.088        7
                                                 4.088        7
                                                 4.0164       8
                                                 3.7584       9
                                                 3.7584       9
                                                 4.0141       7
                                                 4.0141       7
                                                 4.0405       6
                                                 3.6883      10
                                                 3.6883      10
    8    S                   4.368        9
                                                 4.0164       7
                                                 4.088        8
                                                 4.088        8
                                                 3.6858       9
                                                 3.6858       9
                                                 3.9877      10
                                                 3.8105       6
                                                 3.8105       6
                                                 3.4202       9
    9    S                   4.368       10
                                                 3.7584       7
                                                 3.7584       7
                                                 3.6858       8
                                                 3.6858       8
                                                 4.088        9
                                                 4.088        9
                                                 3.908       10
                                                 3.908       10
                                                 3.4202       8
                                                 4.1774      10
   10    S                   4.368       11
                                                 4.114        6
                                                 3.9877       8
                                                 3.908        9
                                                 3.908        9
                                                 4.088       10
                                                 4.088       10
                                                 3.7495       6
                                                 3.7495       6
                                                 3.6883       7
                                                 3.6883       7
                                                 4.1774       9

  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   2   0  4.456   8.912   0.05   328.36    2       33.2       86.2
    2   1   1   0  4.496   8.993   0.051  322.44    4       25.9      103.1
    3   1   2   0  5.93   11.86    0.067  184.42    4       40.8      145.9
    4   1   3   0  7.757  15.514   0.088  106.83    4      123.6      776.1
    5   2   0   0  7.827  15.655   0.088  104.88    2       30.7       23.5
    6   2   1   0  8.142  16.283   0.092   96.78    4       69.6      223.0
    7   0   4   0  8.939  17.878   0.101   79.9     2      111.3      235.2
    8   2   2   0  9.021  18.041   0.102   78.42    4       64.8      156.5
    9   1   4   0  9.767  19.535   0.11    66.57    4       53.2       89.5
   10   2   3   0 10.326  20.651   0.116   59.34    4      211.6     1264.2
   11   1   0   1 11.558  23.115   0.13    46.94    4      154.0      529.7
   12   0   2   1 11.76   23.52    0.132   45.26    4      130.8      368.6
   13   1   1   1 11.776  23.552   0.132   45.14    8      146.4      920.5
   14   1   5   0 11.878  23.755   0.134   44.33    4      329.1     2284.7
   15   2   4   0 11.924  23.849   0.134   43.97    4      327.9     2248.4
   16   3   1   0 12.002  24.004   0.135   43.37    4      483.5     4824.3
   17   1   2   1 12.409  24.818   0.139   40.44    8      314.0     3795.0
   18   3   2   0 12.624  25.249   0.142   39.0     4      130.3      315.1
   19   1   3   1 13.402  26.804   0.15    34.38    8      379.3     4705.0
   20   0   6   0 13.478  26.957   0.151   33.97    2       97.6       76.9
   21   3   3   0 13.603  27.205   0.153   33.31    4      199.1      628.1
   22   2   1   1 13.634  27.267   0.153   33.15    8       97.2      297.9
   23   2   5   0 13.722  27.445   0.154   32.7     4      375.0     2188.1
   24   1   6   0 14.053  28.106   0.158   31.09    4      460.9     3142.2
   25   0   4   1 14.136  28.273   0.159   30.7     4      147.3      316.8
   26   2   2   1 14.189  28.379   0.159   30.45    8      239.3     1659.0
   27   1   4   1 14.687  29.375   0.165   28.29    8      114.5      352.8
   28   3   4   0 14.872  29.744   0.167   27.55    4       59.4       46.2
   29   2   3   1 15.074  30.147   0.169   26.76    8      506.5     6531.3
   30   2   6   0 15.661  31.322   0.175   24.65    4      474.7     2642.8
   31   4   0   0 15.806  31.611   0.177   24.17    2       17.7        1.8
   32   4   1   0 15.97   31.94    0.179   23.64    4      219.7      542.8
   33   3   0   1 16.136  32.271   0.18    23.11    4      381.3     1598.8
   34   1   5   1 16.203  32.406   0.181   22.91    8       69.6      105.7
   35   2   4   1 16.238  32.477   0.182   22.8     8      477.3     4941.6
   36   1   7   0 16.279  32.559   0.182   22.68    4       48.9       25.8
   37   3   1   1 16.297  32.594   0.182   22.62    8      358.7     2769.2
   38   3   5   0 16.372  32.745   0.183   22.4     4        4.8        0.2
   39   4   2   0 16.454  32.907   0.184   22.16    4      154.3      251.1
   40   3   2   1 16.772  33.544   0.187   21.26    8      145.6      428.7
   41   4   3   0 17.233  34.466   0.192   20.04    4      160.8      246.6
   42   0   6   1 17.44   34.881   0.195   19.52    4      187.6      326.9
   43   3   3   1 17.539  35.078   0.196   19.28    8      116.9      250.7
   44   2   5   1 17.635  35.269   0.197   19.05    8       68.3       84.5
   45   2   7   0 17.705  35.411   0.197   18.89    4      350.4     1103.2
   46   1   6   1 17.9    35.799   0.2     18.44    8      137.8      333.1
   47   3   6   0 18.055  36.11    0.201   18.1     4       50.9       22.3
   48   0   8   0 18.106  36.211   0.202   17.99    2      202.2      174.9
   49   4   4   0 18.275  36.55    0.204   17.62    4       24.7        5.1
   50   1   8   0 18.551  37.101   0.207   17.05    4      112.4      102.5
   51   3   4   1 18.566  37.133   0.207   17.02    8       93.7      142.0
   52   2   6   1 19.221  38.441   0.214   15.77    8      186.4      521.1
   53   4   1   1 19.479  38.959   0.216   15.31    8      126.5      233.1
   54   4   5   0 19.544  39.089   0.217   15.19    4      195.7      276.7
   55   1   7   1 19.741  39.481   0.219   14.86    8      316.1     1412.4
   56   3   5   1 19.82   39.639   0.22    14.73    8      121.2      205.9
   57   2   8   0 19.834  39.668   0.22    14.71    4       54.2       20.6
   58   3   7   0 19.883  39.767   0.221   14.62    4      184.4      236.4
   59   4   2   1 19.888  39.777   0.221   14.62    8      407.1     2305.2
   60   5   1   0 20.04   40.08    0.222   14.37    4       95.6       62.5
   61   5   2   0 20.44   40.879   0.227   13.75    4       17.3        2.0
   62   4   3   1 20.555  41.11    0.228   13.58    8      360.2     1676.4
   63   1   9   0 20.866  41.732   0.231   13.13    4       21.6        2.9
   64   2   7   1 20.963  41.926   0.232   13.0     8      130.7      211.3
   65   4   6   0 21.007  42.015   0.233   12.94    4      223.7      308.1
   66   5   3   0 21.092  42.184   0.234   12.82    4      266.1      432.0
   67   3   6   1 21.267  42.534   0.235   12.59    8      108.7      141.4
   68   0   8   1 21.311  42.622   0.236   12.53    4      672.7     2697.0
   69   4   4   1 21.459  42.918   0.237   12.33    8      218.1      558.4
   70   1   8   1 21.7    43.401   0.24    12.03    8       56.8       36.9
   71   3   8   0 21.833  43.666   0.241   11.86    4      142.0      113.8
   72   5   4   0 21.978  43.956   0.243   11.69    4      266.3      394.4
   73   2   9   0 22.037  44.074   0.244   11.62    4      234.0      302.7
   74   0   0   2 22.139  44.277   0.245   11.5     2     1082.1     3202.7
   75   4   5   1 22.579  45.157   0.249   11.0     8       86.2       77.7
   76   0   2   2 22.63   45.259   0.25    10.94    4       22.3        2.6
   77   4   7   0 22.636  45.272   0.25    10.94    4      233.8      284.3
   78   1   1   2 22.639  45.277   0.25    10.93    8       24.0        6.0
   79   2   8   1 22.837  45.674   0.252   10.72    8       11.7        1.4
   80   0  10   0 22.859  45.718   0.252   10.7     2      380.9      369.2
   81   3   7   1 22.881  45.762   0.252   10.67    8      215.0      469.5
   82   5   0   1 22.901  45.801   0.253   10.65    4      321.1      522.6
   83   1   2   2 23.001  46.003   0.254   10.55    8       32.9       10.8
   84   5   1   1 23.021  46.042   0.254   10.53    8       19.7        3.9
   85   5   5   0 23.078  46.155   0.254   10.47    4      657.1     2150.5
   86   1  10   0 23.228  46.455   0.256   10.32    4      166.3      135.8
   87   5   2   1 23.379  46.758   0.258   10.17    8      187.2      339.0
   88   1   3   2 23.596  47.193   0.26     9.96    8       95.6       86.6
   89   2   0   2 23.622  47.244   0.26     9.93    4       21.5        2.2
   90   2   1   2 23.74   47.479   0.261    9.82    8       59.1       32.6
   91   1   9   1 23.763  47.526   0.262    9.8     8       72.0       48.3
   92   3   9   0 23.886  47.773   0.263    9.68    4      374.0      644.4
   93   4   6   1 23.891  47.781   0.263    9.68    8      425.5     1667.4
   94   5   3   1 23.967  47.934   0.264    9.61    8      268.3      658.1
   95   0   4   2 24.056  48.112   0.265    9.53    4       90.2       36.9
   96   2   2   2 24.09   48.179   0.265    9.5     8       56.1       28.5
   97   6   0   0 24.115  48.229   0.265    9.48    2      538.4      653.4
   98   6   1   0 24.23   48.461   0.266    9.37    4      171.0      130.4
   99   2  10   0 24.308  48.616   0.267    9.31    4      113.5       57.0
  100   5   6   0 24.369  48.737   0.268    9.25    4      295.8      385.3
  101   4   8   0 24.408  48.817   0.268    9.22    4      116.5       59.5
  102   1   4   2 24.411  48.822   0.268    9.22    8       51.0       22.8
  103   6   2   0 24.575  49.15    0.27     9.08    4       80.6       28.1
  104   3   8   1 24.64   49.279   0.271    9.02    8      131.5      148.4
  105   2   3   2 24.665  49.329   0.271    9.0     8      178.3      272.3
  106   5   4   1 24.772  49.544   0.272    8.91    8        2.1        0.0
  107   2   9   1 24.826  49.651   0.273    8.87    8      219.6      406.9
  108   6   3   0 25.142  50.284   0.276    8.62    4      163.1      109.1
  109   4   7   1 25.374  50.748   0.278    8.44    8      211.4      359.0
  110   1   5   2 25.429  50.858   0.279    8.4     8      278.0      617.7
  111   2   4   2 25.453  50.907   0.279    8.38    8      281.1      629.9
  112   3   1   2 25.494  50.988   0.279    8.35    8      410.8     1340.5
  113   0  10   1 25.579  51.157   0.28     8.29    4      491.8      953.7
  114   1  11   0 25.639  51.278   0.281    8.24    4      346.0      469.5
  115   5   5   1 25.78   51.56    0.282    8.14    8      311.5      751.4
  116   3   2   2 25.826  51.652   0.283    8.11    8      113.2       98.9
  117   5   7   0 25.832  51.664   0.283    8.1     4       62.3       15.0
  118   1  10   1 25.918  51.836   0.284    8.04    8      180.7      249.8
  119   6   4   0 25.92   51.84    0.284    8.04    4       18.3        1.3
  120   3  10   0 26.034  52.067   0.285    7.96    4      330.9      414.6
  121   0   6   2 26.302  52.604   0.288    7.78    4       84.9       26.7
  122   4   9   0 26.308  52.616   0.288    7.77    4       16.7        1.0
  123   3   3   2 26.373  52.746   0.288    7.73    8      170.8      214.5
  124   2   5   2 26.442  52.885   0.289    7.68    8      305.0      680.2
  125   3   9   1 26.527  53.054   0.29     7.63    8      480.5     1675.7
  126   1   6   2 26.635  53.27    0.291    7.56    8      393.7     1114.6
  127   2  11   0 26.647  53.293   0.291    7.55    4      216.1      167.7
  128   6   1   1 26.846  53.692   0.293    7.42    8      204.1      294.2
  129   6   5   0 26.897  53.793   0.294    7.39    4       20.5        1.5
  130   2  10   1 26.918  53.836   0.294    7.38    8       16.6        1.9
  131   5   6   1 26.975  53.949   0.294    7.34    8      113.4       89.8
  132   4   8   1 27.012  54.023   0.295    7.32    8       68.3       32.4
  133   3   4   2 27.126  54.252   0.296    7.25    8       48.3       16.1
  134   6   2   1 27.167  54.333   0.296    7.22    8      219.9      332.4
  135   5   8   0 27.45   54.9     0.299    7.06    4      140.1       65.8
  136   2   6   2 27.617  55.234   0.301    6.96    8      393.2     1023.6
  137   6   3   1 27.695  55.39    0.302    6.92    8        4.4        0.1
  138   4   0   2 27.709  55.418   0.302    6.91    4       12.8        0.5
  139   0  12   0 27.785  55.57    0.303    6.86    2      244.8       97.9
  140   4   1   2 27.814  55.627   0.303    6.85    8      191.2      238.3
  141   1   7   2 28.013  56.026   0.305    6.74    8       48.9       15.3
  142   6   6   0 28.058  56.117   0.305    6.71    4      181.2      104.9
  143   3   5   2 28.074  56.148   0.305    6.71    8        4.3        0.1
  144   1  12   0 28.106  56.212   0.306    6.69    4      128.1       52.2
  145   4   2   2 28.127  56.254   0.306    6.68    8      140.6      125.6
  146   1  11   1 28.161  56.321   0.306    6.66    8       72.2       33.0
  147   3  11   0 28.27   56.54    0.307    6.6     4      114.0       40.8
  148   4  10   0 28.323  56.645   0.308    6.57    4      146.8       67.3
  149   5   7   1 28.342  56.683   0.308    6.56    8       23.0        3.3
  150   6   4   1 28.424  56.849   0.309    6.52    8       53.0       17.4
  151   3  10   1 28.531  57.062   0.31     6.46    8       14.6        1.3
  152   7   1   0 28.57   57.141   0.31     6.44    4      252.1      194.8
  153   4   3   2 28.644  57.287   0.311    6.41    8      133.8      109.1
  154   4   9   1 28.789  57.578   0.313    6.33    8      115.0       79.7
  155   7   2   0 28.878  57.756   0.313    6.29    4      347.3      361.0
  156   2   7   2 28.964  57.928   0.314    6.25    8      297.1      524.6
  157   2  12   0 29.054  58.109   0.315    6.2     4      302.4      270.0
  158   2  11   1 29.108  58.216   0.316    6.18    8      197.3      228.8
  159   3   6   2 29.204  58.409   0.317    6.13    8       43.9       11.2
  160   5   9   0 29.21   58.419   0.317    6.13    4       57.3        9.6
  161   0   8   2 29.239  58.479   0.317    6.12    4      170.8       84.9
  162   6   5   1 29.344  58.688   0.318    6.07    8       23.0        3.0
  163   4   4   2 29.357  58.715   0.318    6.06    8       23.0        3.1
  164   7   3   0 29.386  58.773   0.319    6.05    4      266.6      204.5
  165   6   7   0 29.392  58.784   0.319    6.04    4        7.0        0.1
  166   1   8   2 29.55   59.1     0.32     5.97    8       95.2       51.5
  167   5   8   1 29.868  59.735   0.323    5.83    8        1.1        0.0
  168   7   4   0 30.089  60.178   0.325    5.74    4      130.9       46.8
  169   0  12   1 30.185  60.37    0.326    5.69    4       96.9       25.5
  170   4   5   2 30.259  60.519   0.327    5.66    8      168.2      152.5
  171   6   6   1 30.445  60.89    0.329    5.59    8       71.0       26.8
  172   4  11   0 30.447  60.893   0.329    5.59    4      356.9      338.6
  173   2   8   2 30.47   60.94    0.329    5.58    8       47.2       11.8
  174   1  12   1 30.49   60.98    0.329    5.57    8      278.9      412.1
  175   3   7   2 30.506  61.012   0.33     5.56    8      161.3      137.7
  176   3  12   0 30.594  61.188   0.33     5.53    4       77.6       15.8
  177   5   1   2 30.621  61.242   0.331    5.52    8       83.9       37.0
  178   1  13   0 30.635  61.27    0.331    5.51    4       47.7        6.0
  179   3  11   1 30.646  61.292   0.331    5.51    8      118.0       73.0
  180   4  10   1 30.696  61.392   0.331    5.49    8        0.0        0.0
  181   7   0   1 30.834  61.668   0.333    5.43    4        2.7        0.0
  182   6   8   0 30.886  61.771   0.333    5.41    4       14.1        0.5
  183   5   2   2 30.916  61.832   0.334    5.4     8       15.1        1.2
  184   7   1   1 30.932  61.864   0.334    5.39    8      147.4      111.4
  185   7   5   0 30.978  61.956   0.334    5.38    4      163.0       67.9
  186   5  10   0 31.101  62.202   0.335    5.33    4       29.5        2.2
  187   7   2   1 31.225  62.451   0.337    5.28    8      308.8      479.3
  188   1   9   2 31.234  62.469   0.337    5.28    8       17.6        1.6
  189   4   6   2 31.341  62.681   0.338    5.24    8      194.9      189.4
  190   2  12   1 31.394  62.787   0.338    5.22    8      298.5      442.5
  191   5   3   2 31.404  62.808   0.338    5.22    8      229.0      260.3
  192   2  13   0 31.536  63.073   0.34     5.17    4      110.7       30.2
  193   5   9   1 31.542  63.084   0.34     5.17    8       12.1        0.7
  194   7   3   1 31.711  63.422   0.341    5.11    8      291.0      411.4
  195   6   7   1 31.716  63.432   0.341    5.1     8      208.1      210.2
  196   3   8   2 31.969  63.937   0.344    5.02    8      122.8       72.0
  197   7   6   0 32.045  64.091   0.344    4.99    4      132.2       41.5
  198   5   4   2 32.081  64.161   0.345    4.98    8      230.4      251.6
  199   2   9   2 32.126  64.252   0.345    4.96    8      204.8      198.2
  200   7   4   1 32.384  64.767   0.348    4.88    8      142.6       94.4
  201   6   9   0 32.529  65.059   0.349    4.83    4      199.5       91.5
  202   4   7   2 32.592  65.184   0.35     4.81    8      203.4      189.3
  203   4  12   0 32.677  65.353   0.35     4.78    4      421.9      405.2
  204   4  11   1 32.727  65.454   0.351    4.77    8       73.4       24.4
  205   0  10   2 32.767  65.533   0.351    4.76    4      336.4      256.1
  206   3  12   1 32.868  65.737   0.352    4.72    8       79.4       28.3
  207   1  13   1 32.908  65.816   0.353    4.71    8      244.1      267.2
  208   5   5   2 32.939  65.878   0.353    4.7     8      575.7     1483.3
  209   0  14   0 32.946  65.892   0.353    4.7     2       21.7        0.5
  210   8   0   0 33.008  66.016   0.354    4.68    2      163.9       29.9
  211   3  13   0 33.008  66.016   0.354    4.68    4      196.1       85.6
  212   1  10   2 33.058  66.116   0.354    4.67    8      145.3       93.7
  213   8   1   0 33.102  66.205   0.355    4.65    4      137.9       42.1
  214   5  11   0 33.118  66.236   0.355    4.65    4      162.5       58.4
  215   6   8   1 33.149  66.297   0.355    4.64    8      441.6      860.9
  216   1  14   0 33.236  66.472   0.356    4.61    4       82.5       15.0
  217   7   5   1 33.238  66.476   0.356    4.61    8      132.1       76.6
  218   7   7   0 33.282  66.565   0.356    4.6     4       49.1        5.3
  219   5  10   1 33.356  66.712   0.357    4.58    8      126.5       69.7
  220   8   2   0 33.385  66.77    0.357    4.57    4       10.0        0.2
  221   3   9   2 33.584  67.167   0.359    4.51    8      331.0      470.5
  222   6   0   2 33.767  67.535   0.361    4.46    4      475.5      479.9
  223   2  13   1 33.776  67.552   0.361    4.46    8       64.5       17.7
  224   8   3   0 33.854  67.708   0.362    4.44    4      166.2       58.3
  225   6   1   2 33.861  67.722   0.362    4.44    8      150.7       95.9
  226   2  10   2 33.924  67.848   0.362    4.42    8      100.4       42.4
  227   5   6   2 33.973  67.946   0.363    4.41    8      262.0      287.7
  228   4   8   2 34.005  68.01    0.363    4.4     8      101.9       43.5
  229   2  14   0 34.1    68.2     0.364    4.37    4      117.0       28.5
  230   6   2   2 34.141  68.281   0.364    4.36    8       71.2       21.0
  231   7   6   1 34.267  68.535   0.365    4.33    8       95.1       37.2
  232   6  10   0 34.316  68.633   0.366    4.32    4      370.6      281.9
  233   8   4   0 34.505  69.01    0.368    4.27    4      383.7      298.9
  234   6   3   2 34.605  69.209   0.369    4.24    8      143.6       83.2
  235   7   8   0 34.682  69.363   0.369    4.22    4        5.2        0.1
  236   1   0   3 34.706  69.411   0.37     4.22    4      119.8       28.8
  237   6   9   1 34.736  69.471   0.37     4.21    8      111.7       49.9
  238   0   2   3 34.791  69.582   0.37     4.2     4      100.0       20.0
  239   1   1   3 34.798  69.596   0.37     4.19    8      105.4       44.3
  240   4  12   1 34.878  69.756   0.371    4.17    8      152.1       91.9
  241   4  13   0 35.014  70.027   0.372    4.14    4        0.8        0.0
  242   1  11   2 35.015  70.031   0.372    4.14    8      307.1      371.6
  243   1   2   3 35.074  70.148   0.373    4.13    8      238.0      222.5
  244   0  14   1 35.139  70.278   0.374    4.11    4       84.1       13.8
  245   5   7   2 35.176  70.352   0.374    4.1     8       55.1       11.9
  246   3  13   1 35.199  70.398   0.374    4.1     8        8.6        0.3
  247   6   4   2 35.249  70.499   0.375    4.09    8       15.4        0.9
  248   5  12   0 35.257  70.515   0.375    4.08    4       13.9        0.4
  249   8   1   1 35.291  70.582   0.375    4.08    8      110.5       47.4
  250   5  11   1 35.306  70.612   0.375    4.07    8       19.6        1.5
  251   8   5   0 35.334  70.668   0.375    4.07    4        0.2        0.0
  252   3  10   2 35.344  70.689   0.376    4.06    8      291.8      329.3
  253   1  14   1 35.421  70.842   0.376    4.05    8      263.0      266.4
  254   7   7   1 35.466  70.931   0.377    4.04    8      437.7      735.6
  255   3  14   0 35.517  71.034   0.377    4.02    4       76.0       11.1
  256   1   3   3 35.533  71.065   0.377    4.02    8      294.9      332.8
  257   8   2   1 35.565  71.131   0.378    4.01    8       23.4        2.1
  258   4   9   2 35.574  71.148   0.378    4.01    8       13.7        0.7
  259   2   1   3 35.644  71.288   0.378    4.0     8       72.4       19.9
  260   2  11   2 35.859  71.718   0.38     3.95    8      192.2      138.8
  261   0   4   3 35.891  71.781   0.381    3.94    4      109.2       22.3
  262   2   2   3 35.917  71.834   0.381    3.94    8      178.8      119.8
  263   1  15   0 35.92   71.84    0.381    3.94    4      320.0      191.8
  264   8   3   1 36.021  72.042   0.382    3.91    8       52.5       10.3
  265   6   5   2 36.071  72.141   0.382    3.9     8       18.4        1.3
  266   1   4   3 36.17   72.34    0.383    3.88    8       90.0       29.9
  267   7   9   0 36.237  72.474   0.384    3.87    4       13.2        0.3
  268   6  11   0 36.242  72.484   0.384    3.87    4      174.2       55.8
  269   2  14   1 36.26   72.521   0.384    3.87    8      278.7      285.6
  270   8   6   0 36.336  72.672   0.385    3.85    4      202.1       74.8
  271   2   3   3 36.371  72.742   0.385    3.84    8      374.7      513.4
  272   6  10   1 36.471  72.942   0.386    3.82    8       10.1        0.4
  273   5   8   2 36.542  73.084   0.386    3.81    8      125.3       56.8
  274   8   4   1 36.655  73.31    0.388    3.79    8      254.7      233.7
  275   2  15   0 36.755  73.51    0.388    3.77    4      317.4      180.5
  276   7   8   1 36.827  73.654   0.389    3.75    8      295.1      310.8
  277   0  12   2 36.829  73.658   0.389    3.75    4      218.2       85.0
  278   3   0   3 36.945  73.891   0.39     3.73    4      277.8      136.9
  279   1   5   3 36.983  73.966   0.39     3.72    8       53.5       10.1
  280   2   4   3 37.003  74.005   0.391    3.72    8      357.6      452.6
  281   3   1   3 37.035  74.071   0.391    3.71    8      270.9      259.3
  282   6   6   2 37.065  74.129   0.391    3.71    8      162.4       93.1
  283   1  12   2 37.105  74.211   0.392    3.7     8      113.8       45.6
  284   4  13   1 37.151  74.302   0.392    3.69    8       50.0        8.8
  285   3  11   2 37.247  74.495   0.393    3.67    8      102.4       36.7
  286   4  10   2 37.293  74.586   0.393    3.67    8      131.4       60.2
  287   3   2   3 37.305  74.61    0.393    3.66    8      109.0       41.4
  288   5  12   1 37.389  74.778   0.394    3.65    8      267.6      248.5
  289   4  14   0 37.462  74.925   0.395    3.64    4      255.9      113.3
  290   8   5   1 37.464  74.928   0.395    3.64    8      215.6      160.7
  291   8   7   0 37.506  75.013   0.395    3.63    4       10.6        0.2
  292   7   1   2 37.508  75.016   0.395    3.63    8      225.5      175.5
  293   5  13   0 37.521  75.042   0.395    3.63    4       13.5        0.3
  294   3  14   1 37.643  75.286   0.396    3.6     8       19.9        1.4
  295   0   6   3 37.694  75.387   0.397    3.6     4      145.1       36.0
  296   3   3   3 37.752  75.504   0.397    3.59    8       87.1       25.9
  297   7   2   2 37.776  75.553   0.398    3.58    8      310.8      329.1
  298   2   5   3 37.809  75.618   0.398    3.58    8       45.6        7.1
  299   9   1   0 37.885  75.77    0.399    3.56    4      137.3       31.9
  300   2  12   2 37.93   75.861   0.399    3.56    8      271.3      248.9
  301   7  10   0 37.945  75.89    0.399    3.55    4      277.2      129.8
  302   1   6   3 37.968  75.936   0.399    3.55    8      102.0       35.1
  303   1  15   1 38.037  76.075   0.4      3.54    8       40.4        5.5
  304   5   9   2 38.067  76.133   0.4      3.53    8       51.5        8.9
  305   3  15   0 38.131  76.262   0.401    3.52    4        5.1        0.0
  306   9   2   0 38.152  76.304   0.401    3.52    4      224.4       84.3
  307   7   3   2 38.222  76.444   0.402    3.51    8      238.4      189.7
  308   6   7   2 38.227  76.453   0.402    3.51    8        6.0        0.1
  309   6  12   0 38.306  76.612   0.402    3.49    4      162.2       43.8
  310   7   9   1 38.348  76.696   0.403    3.49    8      144.5       69.2
  311   6  11   1 38.353  76.705   0.403    3.49    8      128.4       54.7
  312   3   4   3 38.376  76.751   0.403    3.48    8       71.8       17.1
  313   0  16   0 38.429  76.857   0.403    3.48    2      243.3       48.9
  314   8   6   1 38.445  76.889   0.404    3.47    8       35.0        4.0
  315   9   3   0 38.596  77.193   0.405    3.45    4       97.7       15.7
  316   1  16   0 38.701  77.402   0.406    3.43    4      259.2      109.7
  317   2   6   3 38.787  77.574   0.407    3.42    8      144.7       68.1
  318   8   8   0 38.841  77.682   0.407    3.41    4      198.5       64.0
  319   7   4   2 38.843  77.686   0.407    3.41    8      118.2       45.4
  320   2  15   1 38.856  77.711   0.407    3.41    8      358.0      416.0
  321   4   1   3 38.952  77.905   0.408    3.4     8       96.0       29.8
  322   1   7   3 39.121  78.242   0.41     3.37    8      246.1      194.3
  323   4  11   2 39.161  78.322   0.41     3.37    8      320.7      329.4
  324   3   5   3 39.173  78.345   0.41     3.36    8       94.8       28.8
  325   9   4   0 39.215  78.431   0.41     3.36    4       32.0        1.6
  326   4   2   3 39.217  78.435   0.41     3.36    8      315.9      318.9
  327   3  12   2 39.293  78.585   0.411    3.35    8       69.5       15.4
  328   1  13   2 39.33   78.659   0.411    3.34    8       42.3        5.7
  329   2  16   0 39.515  79.031   0.413    3.32    4       81.7       10.5
  330   4  14   1 39.551  79.101   0.413    3.31    8       54.3        9.3
  331   6   8   2 39.554  79.108   0.413    3.31    8       13.0        0.5
  332   8   7   1 39.594  79.187   0.414    3.31    8      109.5       37.7
  333   5  13   1 39.608  79.216   0.414    3.31    8      594.4     1111.0
  334   7   5   2 39.637  79.274   0.414    3.3     8      148.0       68.8
  335   4   3   3 39.658  79.316   0.414    3.3     8      279.9      245.9
  336   5  10   2 39.747  79.495   0.415    3.29    8       26.3        2.2
  337   7  11   0 39.803  79.606   0.416    3.28    4      333.8      173.8
  338   9   0   1 39.878  79.757   0.416    3.27    4      246.3       94.4
  339   5  14   0 39.913  79.827   0.416    3.27    4       14.7        0.3
  340   2   7   3 39.933  79.866   0.417    3.26    8      103.0       32.9
  341   9   1   1 39.966  79.932   0.417    3.26    8      434.1      584.3
  342   9   5   0 40.008  80.015   0.417    3.25    4       31.9        1.6
  343   7  10   1 40.025  80.05    0.417    3.25    8      172.6       92.2
  344   4  15   0 40.032  80.063   0.418    3.25    4      196.4       59.7
  345   2  13   2 40.14   80.28    0.418    3.24    8       99.4       30.4
  346   3   6   3 40.14   80.281   0.418    3.24    8       84.3       21.9
  347   0   8   3 40.171  80.341   0.419    3.23    4      529.0      430.5
  348   3  15   1 40.209  80.417   0.419    3.23    8      166.6       85.2
  349   9   2   1 40.229  80.459   0.419    3.23    8      173.7       92.6
  350   4   4   3 40.273  80.545   0.42     3.22    8      173.2       92.0
  351   8   9   0 40.338  80.675   0.42     3.21    4      177.8       48.3
  352   6  12   1 40.381  80.762   0.421    3.21    8      148.5       67.4
  353   1   8   3 40.44   80.88    0.421    3.2     8       45.1        6.2
  354   0  16   1 40.502  81.004   0.422    3.19    4        8.9        0.1
  355   6  13   0 40.51   81.019   0.422    3.19    4       27.7        1.2
  356   7   6   2 40.602  81.204   0.422    3.18    8      119.5       43.2
  357   9   3   1 40.667  81.334   0.423    3.17    8      156.2       73.7
  358   1  16   1 40.771  81.541   0.424    3.16    8       78.4       18.5
  359   3  16   0 40.863  81.725   0.425    3.15    4      122.2       22.4
  360   8   8   1 40.909  81.817   0.425    3.15    8       45.2        6.1
  361   9   6   0 40.971  81.941   0.426    3.14    4       41.4        2.6
  362   6   9   2 41.044  82.088   0.426    3.13    8      178.7       95.2
  363   4   5   3 41.06   82.12    0.426    3.13    8       70.0       14.6
  364   4  12   2 41.179  82.357   0.427    3.12    8      382.2      433.5
  365   2   8   3 41.246  82.491   0.428    3.11    8       10.9        0.4
  366   3   7   3 41.277  82.554   0.428    3.11    8      170.4       85.9
  367   9   4   1 41.278  82.557   0.428    3.11    8       17.0        0.9
  368   5   0   3 41.291  82.583   0.428    3.11    4      255.1       96.2
  369   5   1   3 41.379  82.757   0.429    3.1     8       15.8        0.7
  370   0  14   2 41.426  82.852   0.429    3.09    4       20.0        0.6
  371   8   0   2 41.483  82.966   0.43     3.09    4      148.9       32.6
  372   3  13   2 41.483  82.966   0.43     3.09    8      177.5       92.5
  373   8   1   2 41.57   83.14    0.431    3.08    8      124.8       45.6
  374   2  16   1 41.575  83.15    0.431    3.08    8       49.7        7.2
  375   5  11   2 41.584  83.169   0.431    3.08    8      147.7       63.9
  376   1  17   0 41.597  83.194   0.431    3.08    4       76.8        8.6
  377   5   2   3 41.64   83.28    0.431    3.07    8      149.6       65.4
  378   1  14   2 41.694  83.387   0.432    3.07    8       73.1       15.6
  379   7   7   2 41.736  83.473   0.432    3.06    8       44.5        5.8
  380   7  12   0 41.814  83.627   0.433    3.06    4       99.0       14.3
  381   8   2   2 41.831  83.662   0.433    3.05    8        9.6        0.3
  382   7  11   1 41.86   83.719   0.433    3.05    8      121.1       42.6
  383   1   9   3 41.923  83.846   0.434    3.05    8       55.9        9.1
  384   5  14   1 41.969  83.937   0.434    3.04    8      100.8       29.4
  385   8  10   0 41.995  83.991   0.434    3.04    4       24.6        0.9
  386   4   6   3 42.018  84.036   0.434    3.04    8      339.6      333.3
  387   9   5   1 42.062  84.124   0.435    3.03    8       10.1        0.3
  388   5   3   3 42.075  84.15    0.435    3.03    8      215.7      134.3
  389   4  15   1 42.086  84.171   0.435    3.03    8      230.5      153.2
  390   9   7   0 42.103  84.206   0.435    3.03    4      394.5      224.3
  391   8   3   2 42.266  84.532   0.437    3.01    8      150.6       65.1
  392   8   9   1 42.389  84.778   0.438    3.0     8      125.1       44.7
  393   2  17   0 42.398  84.797   0.438    3.0     4      108.6       16.9
  394   5  15   0 42.444  84.888   0.438    3.0     4        0.3        0.0
  395   2  14   2 42.495  84.99    0.438    2.99    8      106.4       32.3
  396   6  13   1 42.559  85.119   0.439    2.99    8      122.9       43.0
  397   3   8   3 42.582  85.163   0.439    2.99    8      104.8       31.2
  398   5   4   3 42.683  85.365   0.44     2.98    8        2.4        0.0
  399   6  10   2 42.697  85.393   0.44     2.98    8      336.7      321.1
  400   2   9   3 42.724  85.447   0.44     2.98    8      176.4       88.1
  401   4  16   0 42.734  85.469   0.44     2.97    4      308.6      134.8
  402   6  14   0 42.86   85.721   0.442    2.96    4       53.4        4.0
  403   8   4   2 42.873  85.746   0.442    2.96    8      347.2      339.9
  404   3  16   1 42.909  85.819   0.442    2.96    8       22.4        1.4
  405  10   0   0 42.917  85.834   0.442    2.96    2      250.3       44.1
  406  10   1   0 43.004  86.008   0.443    2.95    4      277.9      108.5
  407   9   6   1 43.017  86.033   0.443    2.95    8       82.2       19.0
  408   7   8   2 43.039  86.077   0.443    2.95    8        4.8        0.1
  409   4   7   3 43.146  86.292   0.444    2.94    8      170.3       81.2
  410  10   2   0 43.264  86.528   0.445    2.93    4      219.3       67.1
  411   0  10   3 43.305  86.61    0.445    2.93    4      393.9      216.4
  412   4  13   2 43.351  86.701   0.446    2.93    8        1.2        0.0
  413   9   8   0 43.404  86.808   0.446    2.92    4      166.5       38.6
  414   5   5   3 43.463  86.925   0.447    2.92    8      249.8      173.4
  415   1  10   3 43.571  87.142   0.447    2.91    8      146.6       59.6
  416   5  12   2 43.58   87.161   0.447    2.91    8       12.4        0.4
  417   1  17   1 43.639  87.277   0.448    2.91    8       60.7       10.2
  418   8   5   2 43.653  87.306   0.448    2.91    8        0.4        0.0
  419  10   3   0 43.697  87.393   0.448    2.9     4       31.7        1.4
  420   3  17   0 43.73   87.46    0.449    2.9     4      375.0      194.2
  421   8  11   0 43.816  87.633   0.449    2.9     4       79.0        8.6
  422   3  14   2 43.826  87.652   0.449    2.9     8       69.5       13.3
  423   7  12   1 43.854  87.708   0.45     2.89    8       33.9        3.2
  424   7  13   0 43.982  87.963   0.451    2.89    4       35.9        1.8
  425   8  10   1 44.035  88.07    0.451    2.88    8      162.3       72.2
  426   3   9   3 44.054  88.109   0.451    2.88    8      388.5      413.7
  427   9   7   1 44.142  88.284   0.452    2.88    8      187.8       96.5
  428   1  15   2 44.208  88.416   0.453    2.87    8      291.6      232.3
  429  10   4   0 44.302  88.605   0.453    2.87    4       26.4        0.9
  430   6   1   3 44.311  88.621   0.453    2.87    8      163.4       72.8
  431   0  18   0 44.365  88.731   0.454    2.86    2      262.9       47.1
  432   2  10   3 44.369  88.738   0.454    2.86    8       12.1        0.4
  433   5   6   3 44.414  88.829   0.454    2.86    8       92.5       23.3
  434   2  17   1 44.436  88.872   0.454    2.86    8        0.6        0.0
  435   4   8   3 44.444  88.888   0.455    2.86    8       55.1        8.3
  436   5  15   1 44.482  88.963   0.455    2.86    8      180.8       88.8
  437   7   9   2 44.51   89.02    0.455    2.85    8       11.9        0.4
  438   6  11   2 44.515  89.03    0.455    2.85    8      157.6       67.4
  439   6   2   3 44.57   89.14    0.456    2.85    8      179.3       87.2
  440   8   6   2 44.604  89.209   0.456    2.85    8      183.6       91.3
  441   1  18   0 44.631  89.262   0.456    2.85    4      197.4       52.8
  442   4  16   1 44.771  89.542   0.457    2.84    8       77.4       16.2
  443   9   9   0 44.875  89.749   0.458    2.83    4      145.5       28.6
  444   6  14   1 44.897  89.793   0.458    2.83    8       28.2        2.1


  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   2   0   4.456   8.912  9.9145        86.2      1.3      1.3     5.6
    2   1   1   0   4.496   8.993  9.82559      103.1      1.6      1.6     5.6
    3   1   2   0   5.93   11.86   7.45603      145.9      2.2      2.3     5.6
    4   1   3   0   7.757  15.514  5.70687      776.1     11.9     12.0     5.6
    5   2   1   0   8.142  16.283  5.43906      223.0      3.4      3.4     5.6
    6   0   4   0   8.939  17.878  4.95725      235.2      3.6      3.6     5.6
    7   2   2   0   9.021  18.041  4.91279      156.5      2.4      2.4     5.6
    8   1   4   0   9.767  19.535  4.5404        89.5      1.4      1.4     5.6
    9   2   3   0  10.326  20.651  4.29738     1264.2     19.4     19.5     5.6
   10   1   0   1  11.558  23.115  3.84465      529.7      8.1      8.2     5.6
   11   1   1   1  11.776  23.552  3.77436     1289.1     19.7     19.8     5.6
   12   1   5   0  11.878  23.755  3.74247     2284.7     35.0     35.2     5.6
   13   2   4   0  11.924  23.849  3.72801     2248.4     34.4     34.6     5.6
   14   3   1   0  12.002  24.004  3.70429     4824.3     73.9     74.2     5.6
   15   1   2   1  12.409  24.818  3.58457     3795.0     58.1     58.3     5.6
   16   3   2   0  12.624  25.249  3.52438      315.1      4.8      4.8     5.6
   17   1   3   1  13.402  26.804  3.32333     4705.0     72.0     72.2     5.6
   18   0   6   0  13.478  26.957  3.30483       76.9      1.2      1.2     5.6
   19   3   3   0  13.603  27.205  3.2752       628.1      9.6      9.6     5.6
   20   2   1   1  13.634  27.267  3.26789      297.9      4.6      4.6     5.6
   21   2   5   0  13.722  27.445  3.24713     2188.1     33.5     33.6     5.6
   22   1   6   0  14.053  28.106  3.17223     3142.2     48.1     48.2     5.6
   23   0   4   1  14.136  28.273  3.15391      316.8      4.9      4.9     5.6
   24   2   2   1  14.189  28.379  3.14237     1659.0     25.4     25.4     5.6
   25   1   4   1  14.687  29.375  3.03804      352.8      5.4      5.4     5.6
   26   2   3   1  15.074  30.147  2.96191     6531.3    100.0    100.0     5.6
   27   2   6   0  15.661  31.322  2.85344     2642.8     40.5     40.4     5.6
   28   4   1   0  15.97   31.94   2.79967      542.8      8.3      8.3     5.6
   29   3   0   1  16.136  32.271  2.77167     1598.8     24.5     24.4     5.6
   30   1   5   1  16.203  32.406  2.76041      105.7      1.6      1.6     5.6
   31   2   4   1  16.238  32.477  2.7546      4941.6     75.7     75.5     5.6
   32   3   1   1  16.297  32.594  2.74498     2795.0     42.8     42.7     5.6
   33   4   2   0  16.454  32.907  2.71953      251.1      3.8      3.8     5.6
   34   3   2   1  16.772  33.544  2.66932      428.7      6.6      6.5     5.7
   35   4   3   0  17.233  34.466  2.60001      246.6      3.8      3.8     5.7
   36   0   6   1  17.44   34.881  2.57005      326.9      5.0      5.0     5.7
   37   3   3   1  17.539  35.078  2.55604      250.7      3.8      3.8     5.7
   38   2   5   1  17.635  35.269  2.54263       84.5      1.3      1.3     5.7
   39   2   7   0  17.705  35.411  2.53281     1103.2     16.9     16.8     5.7
   40   1   6   1  17.9    35.799  2.50618      333.1      5.1      5.1     5.7
   41   0   8   0  18.106  36.211  2.47863      174.9      2.7      2.7     5.7
   42   3   4   1  18.566  37.133  2.41921      244.5      3.7      3.7     5.7
   43   2   6   1  19.221  38.441  2.33982      521.1      8.0      7.9     5.7
   44   4   1   1  19.479  38.959  2.3099       233.1      3.6      3.5     5.7
   45   4   5   0  19.544  39.089  2.30253      276.7      4.2      4.2     5.7
   46   1   7   1  19.741  39.481  2.28054     1412.4     21.6     21.4     5.7
   47   3   5   1  19.82   39.639  2.27182      226.5      3.5      3.4     5.7
   48   4   2   1  19.888  39.777  2.26427     2541.6     38.9     38.6     5.7
   49   4   3   1  20.555  41.11   2.19388     1676.4     25.7     25.4     5.7
   50   2   7   1  20.963  41.926  2.15306      211.3      3.2      3.2     5.7
   51   4   6   0  21.007  42.015  2.14869      308.1      4.7      4.7     5.7
   52   5   3   0  21.092  42.184  2.14048      432.0      6.6      6.5     5.7
   53   3   6   1  21.267  42.534  2.12367      141.4      2.2      2.1     5.7
   54   0   8   1  21.311  42.622  2.11947     2697.0     41.3     40.8     5.7
   55   4   4   1  21.459  42.918  2.10553      558.4      8.6      8.4     5.7
   56   3   8   0  21.833  43.666  2.07121      113.8      1.7      1.7     5.7
   57   5   4   0  21.978  43.956  2.05819      394.4      6.0      6.0     5.7
   58   2   9   0  22.037  44.074  2.05296      302.7      4.6      4.6     5.7
   59   0   0   2  22.139  44.277  2.044       3202.7     49.0     48.4     5.7
   60   4   5   1  22.579  45.157  2.00619       77.7      1.2      1.2     5.7
   61   1   1   2  22.639  45.277  2.00116      292.9      4.5      4.4     5.7
   62   0  10   0  22.859  45.718  1.9829       370.6      5.7      5.6     5.7
   63   5   0   1  22.901  45.801  1.97948      992.1     15.2     15.0     5.7
   64   5   5   0  23.078  46.155  1.96512     2150.5     32.9     32.4     5.7
   65   1  10   0  23.228  46.455  1.95312      135.8      2.1      2.0     5.7
   66   5   2   1  23.379  46.758  1.94117      339.0      5.2      5.1     5.7
   67   1   3   2  23.596  47.193  1.9243        88.8      1.4      1.3     5.7
   68   1   9   1  23.763  47.526  1.91159       80.9      1.2      1.2     5.7
   69   4   6   1  23.891  47.781  1.90197     2311.7     35.4     34.8     5.7
   70   5   3   1  23.967  47.934  1.89627      658.1     10.1      9.9     5.7
   71   6   0   0  24.115  48.229  1.88533      681.8     10.4     10.3     5.7
   72   6   1   0  24.23   48.461  1.87687      130.4      2.0      2.0     5.7
   73   5   6   0  24.369  48.737  1.86686      385.3      5.9      5.8     5.7
   74   4   8   0  24.408  48.817  1.86401       82.3      1.3      1.2     5.7
   75   2   3   2  24.665  49.329  1.84584      420.7      6.4      6.3     5.7
   76   2   9   1  24.826  49.651  1.83461      406.9      6.2      6.1     5.7
   77   6   3   0  25.142  50.284  1.81302      109.1      1.7      1.6     5.8
   78   4   7   1  25.374  50.748  1.79751      359.0      5.5      5.4     5.8
   79   2   4   2  25.453  50.907  1.79228     1247.5     19.1     18.7     5.8
   80   3   1   2  25.494  50.988  1.78963     1340.5     20.5     20.1     5.8
   81   0  10   1  25.579  51.157  1.7841       953.7     14.6     14.3     5.8
   82   1  11   0  25.639  51.278  1.78018      469.5      7.2      7.0     5.8
   83   5   5   1  25.78   51.56   1.77111      751.4     11.5     11.3     5.8
   84   3   2   2  25.826  51.652  1.76815      113.9      1.7      1.7     5.8
   85   1  10   1  25.918  51.836  1.76231      251.1      3.8      3.8     5.8
   86   3  10   0  26.034  52.067  1.75502      414.6      6.3      6.2     5.8
   87   3   3   2  26.373  52.746  1.73402      214.5      3.3      3.2     5.8
   88   2   5   2  26.442  52.885  1.72982      680.2     10.4     10.2     5.8
   89   3   9   1  26.527  53.054  1.7247      1675.7     25.7     25.1     5.8
   90   1   6   2  26.635  53.27   1.71821     1282.2     19.6     19.2     5.8
   91   6   1   1  26.846  53.692  1.70569      294.2      4.5      4.4     5.8
   92   5   6   1  26.975  53.949  1.69817       89.8      1.4      1.3     5.8
   93   6   2   1  27.167  54.333  1.68707      332.4      5.1      5.0     5.8
   94   5   8   0  27.45   54.9    1.67098       65.8      1.0      1.0     5.8
   95   2   6   2  27.617  55.234  1.66166     1023.6     15.7     15.3     5.8
   96   4   1   2  27.814  55.627  1.65084      336.1      5.1      5.0     5.8
   97   6   6   0  28.058  56.117  1.6376       105.0      1.6      1.6     5.8
   98   4   2   2  28.127  56.254  1.63394      177.9      2.7      2.6     5.8
   99   4  10   0  28.323  56.645  1.62356       70.7      1.1      1.1     5.8
  100   7   1   0  28.57   57.141  1.61066      194.8      3.0      2.9     5.8
  101   4   3   2  28.644  57.287  1.60689      109.1      1.7      1.6     5.8
  102   4   9   1  28.789  57.578  1.59947       79.7      1.2      1.2     5.8
  103   7   2   0  28.878  57.756  1.59495      361.0      5.5      5.4     5.8
  104   2   7   2  28.964  57.928  1.59064      524.6      8.0      7.8     5.8
  105   2  12   0  29.054  58.109  1.58611      270.0      4.1      4.0     5.8
  106   2  11   1  29.108  58.216  1.58344      228.8      3.5      3.4     5.8
  107   0   8   2  29.239  58.479  1.57696       84.9      1.3      1.3     5.8
  108   7   3   0  29.386  58.773  1.56976      204.6      3.1      3.0     5.8
  109   4   5   2  30.259  60.519  1.52859      152.5      2.3      2.3     5.8
  110   4  11   0  30.447  60.893  1.52008      377.2      5.8      5.6     5.8
  111   1  12   1  30.49   60.98   1.51814      549.9      8.4      8.1     5.8
  112   3  11   1  30.646  61.292  1.51115      131.7      2.0      1.9     5.8
  113   7   1   1  30.932  61.864  1.49854      112.6      1.7      1.7     5.8
  114   7   5   0  30.978  61.956  1.49653       67.9      1.0      1.0     5.8
  115   7   2   1  31.225  62.451  1.48587      480.8      7.4      7.1     5.8
  116   4   6   2  31.341  62.681  1.48095      189.4      2.9      2.8     5.8
  117   2  12   1  31.394  62.787  1.47871      702.8     10.8     10.4     5.9
  118   7   3   1  31.711  63.422  1.46544      621.6      9.5      9.2     5.9
  119   3   8   2  31.969  63.937  1.45485       72.0      1.1      1.1     5.9
  120   5   4   2  32.081  64.161  1.45032      251.6      3.9      3.7     5.9
  121   2   9   2  32.126  64.252  1.44849      198.2      3.0      2.9     5.9
  122   7   4   1  32.384  64.767  1.4382        94.4      1.4      1.4     5.9
  123   6   9   0  32.529  65.059  1.43246       91.5      1.4      1.3     5.9
  124   4   7   2  32.592  65.184  1.43001      189.3      2.9      2.8     5.9
  125   4  12   0  32.677  65.353  1.42672      405.2      6.2      5.9     5.9
  126   0  10   2  32.767  65.533  1.42323      256.1      3.9      3.8     5.9
  127   1  13   1  32.908  65.816  1.4178       267.2      4.1      3.9     5.9
  128   5   5   2  32.939  65.878  1.41661     1483.8     22.7     21.8     5.9
  129   3  13   0  33.008  66.016  1.414        115.5      1.8      1.7     5.9
  130   1  10   2  33.058  66.116  1.4121        93.7      1.4      1.4     5.9
  131   5  11   0  33.118  66.236  1.40983      100.5      1.5      1.5     5.9
  132   6   8   1  33.149  66.297  1.40867      860.9     13.2     12.6     5.9
  133   7   5   1  33.238  66.476  1.40532       91.6      1.4      1.3     5.9
  134   5  10   1  33.356  66.712  1.40091       69.9      1.1      1.0     5.9
  135   3   9   2  33.584  67.167  1.39253      470.5      7.2      6.9     5.9
  136   6   0   2  33.767  67.535  1.38583      497.6      7.6      7.3     5.9
  137   6   1   2  33.861  67.722  1.38246      154.2      2.4      2.3     5.9
  138   5   6   2  33.973  67.946  1.37845      287.7      4.4      4.2     5.9
  139   6  10   0  34.316  68.633  1.36632      281.9      4.3      4.1     5.9
  140   8   4   0  34.505  69.01   1.35977      298.9      4.6      4.4     5.9
  141   6   3   2  34.605  69.209  1.35634       83.2      1.3      1.2     5.9
  142   4  12   1  34.878  69.756  1.34704       91.9      1.4      1.3     5.9
  143   1  11   2  35.015  70.031  1.34242      371.6      5.7      5.4     5.9
  144   1   2   3  35.074  70.148  1.34046      222.5      3.4      3.2     5.9
  145   3  10   2  35.344  70.689  1.33154      329.3      5.0      4.8     5.9
  146   1  14   1  35.421  70.842  1.32904      266.4      4.1      3.9     5.9
  147   7   7   1  35.466  70.931  1.32758      735.6     11.3     10.7     5.9
  148   1   3   3  35.533  71.065  1.32541      343.9      5.3      5.0     5.9
  149   2  11   2  35.859  71.718  1.31493      138.8      2.1      2.0     5.9
  150   1  15   0  35.92   71.84   1.313        333.9      5.1      4.8     5.9
  151   2  14   1  36.26   72.521  1.30235      341.5      5.2      5.0     5.9
  152   8   6   0  36.336  72.672  1.30001       74.8      1.1      1.1     6.0
  153   2   3   3  36.371  72.742  1.29893      513.4      7.9      7.4     6.0
  154   8   4   1  36.655  73.31   1.29026      233.7      3.6      3.4     6.0
  155   2  15   0  36.755  73.51   1.28724      180.5      2.8      2.6     6.0
  156   7   8   1  36.827  73.654  1.28508      395.8      6.1      5.7     6.0
  157   3   0   3  36.945  73.891  1.28155      136.9      2.1      2.0     6.0
  158   2   4   3  37.003  74.005  1.27985      462.7      7.1      6.7     6.0
  159   3   1   3  37.035  74.071  1.27888      352.4      5.4      5.1     6.0
  160   4  10   2  37.293  74.586  1.27131      101.6      1.6      1.5     6.0
  161   5  12   1  37.389  74.778  1.26852      248.5      3.8      3.6     6.0
  162   8   5   1  37.464  74.928  1.26636      274.0      4.2      4.0     6.0
  163   7   1   2  37.508  75.016  1.26509      175.8      2.7      2.5     6.0
  164   7   2   2  37.776  75.553  1.25743      355.0      5.4      5.1     6.0
  165   2  12   2  37.93   75.861  1.25309      378.8      5.8      5.5     6.0
  166   9   2   0  38.152  76.304  1.24691       84.3      1.3      1.2     6.0
  167   7   3   2  38.222  76.444  1.24498      189.9      2.9      2.7     6.0
  168   7   9   1  38.348  76.696  1.24152      141.1      2.2      2.0     6.0
  169   1  16   0  38.701  77.402  1.23194      109.7      1.7      1.6     6.0
  170   2   6   3  38.787  77.574  1.22965       68.1      1.0      1.0     6.0
  171   2  15   1  38.856  77.711  1.22781      525.3      8.0      7.5     6.0
  172   1   7   3  39.121  78.242  1.2208       194.3      3.0      2.8     6.0
  173   4  11   2  39.161  78.322  1.21976      358.2      5.5      5.1     6.0
  174   4   2   3  39.217  78.435  1.21829      320.6      4.9      4.6     6.0
  175   5  13   1  39.608  79.216  1.20822     1148.7     17.6     16.4     6.0
  176   4   3   3  39.658  79.316  1.20695      314.8      4.8      4.5     6.0
  177   7  11   0  39.803  79.606  1.20328      173.8      2.7      2.5     6.0
  178   9   0   1  39.878  79.757  1.20139       94.4      1.4      1.3     6.0
  179   9   1   1  39.966  79.932  1.19919      584.3      8.9      8.3     6.0
  180   4  15   0  40.032  80.063  1.19756      153.4      2.3      2.2     6.0
  181   0   8   3  40.171  80.341  1.19411      430.5      6.6      6.1     6.0
  182   9   2   1  40.229  80.459  1.19266      177.9      2.7      2.5     6.0
  183   4   4   3  40.273  80.545  1.1916        92.0      1.4      1.3     6.1
  184   6  12   1  40.381  80.762  1.18895       67.4      1.0      1.0     6.1
  185   9   3   1  40.667  81.334  1.18202       73.7      1.1      1.0     6.1
  186   6   9   2  41.044  82.088  1.17307      109.8      1.7      1.6     6.1
  187   4  12   2  41.179  82.357  1.16991      433.5      6.6      6.2     6.1
  188   5   0   3  41.291  82.583  1.16729      182.9      2.8      2.6     6.1
  189   3  13   2  41.483  82.966  1.16287      125.1      1.9      1.8     6.1
  190   5  11   2  41.584  83.169  1.16055      125.4      1.9      1.8     6.1
  191   5   2   3  41.64   83.28   1.15928       65.4      1.0      0.9     6.1
  192   4   6   3  42.018  84.036  1.15076      333.3      5.1      4.7     6.1
  193   9   7   0  42.103  84.206  1.14887      511.8      7.8      7.2     6.1
  194   6  13   1  42.559  85.119  1.13887       74.2      1.1      1.0     6.1
  195   6  10   2  42.697  85.393  1.13591      409.2      6.3      5.8     6.1
  196   4  16   0  42.734  85.469  1.1351       134.8      2.1      1.9     6.1
  197   8   4   2  42.873  85.746  1.13213      343.9      5.3      4.8     6.1
  198  10   1   0  43.004  86.008  1.12936      127.5      2.0      1.8     6.1
  199   4   7   3  43.146  86.292  1.12637       81.2      1.2      1.1     6.1
  200  10   2   0  43.264  86.528  1.12391       67.1      1.0      0.9     6.1
  201   0  10   3  43.305  86.61   1.12305      216.4      3.3      3.0     6.1
  202   5   5   3  43.463  86.925  1.11979      173.4      2.7      2.4     6.1
  203   3  17   0  43.73   87.46   1.11432      194.2      3.0      2.7     6.2
  204   3   9   3  44.054  88.109  1.10778      486.0      7.4      6.8     6.2
  205   9   7   1  44.142  88.284  1.10603       96.5      1.5      1.3     6.2
  206   1  15   2  44.208  88.416  1.10471      232.3      3.6      3.2     6.2
  207   6   1   3  44.311  88.621  1.10269       72.8      1.1      1.0     6.2
  208   5  15   1  44.482  88.963  1.09933       89.2      1.4      1.2     6.2
  209   6  11   2  44.515  89.03   1.09868       67.4      1.0      0.9     6.2
  210   6   2   3  44.57   89.14   1.09761       87.2      1.3      1.2     6.2
  211   8   6   2  44.604  89.209  1.09694      144.1      2.2      2.0     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)