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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JERRYGIBBSITE

1

[Mn(7.86)Zn(0.59)Mg(0.24)Ca(0.16)Fe(0.14)][SiO(4)](4)(OH)(2)


Orthorhombic  P bn2(1)  Z = 4

R =0.088

19 .4 .1995

Ref.Str.:

         Toshio Kato et al. (1989)

         * Neues Jb. Miner., Mh., H.9, 410-430

Reserv:

         Pos. Mn(1-9) = Mn+Zn+Mg+Ca+Fe.   N.A.D.

                   Initial data from BDM-file 

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

             a =   4.875    alpha =   90.0 
             b =  10.709    beta  =   90.0 
             c =  28.18     gamma =   90.0 

    Unit cell volume (cub. angs.) =  1471.18

    Molar volume ( cub.cm/mol.) =   221.54

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

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

   1 0.998   0.3804  0.25     0.63   Mn    = 1.00
   2 0.997   0.3725  0.137    0.69   Mn    = 1.00
   3 0.9961  0.3658  0.3619   0.62   Mn    = 1.00
   4 0.0157  0.0976  0.0817   0.86   Mn    = 1.00
   5 0.0013  0.6494  0.4087   0.84   Mn    = 1.00
   6 0.9987  0.6567  0.1927   0.64   Mn    = 1.00
   7 0.0091  0.091   0.301    0.81   Mn    = 1.00
   8 0.9813  0.3722  0.0202   0.92   Mn    = 1.00
   9 0.9937  0.3578  0.4782   0.76   Mn    = 1.00
  10 0.0748  0.9681  0.1942   0.66   Si    = 1.00
  11 0.9353  0.7812  0.3016   0.73   Si    = 1.00
  12 0.0847  0.9618  0.4171   0.94   Si    = 1.00
  13 0.9205  0.7773  0.0806   0.84   Si    = 1.00
  14 0.7435  0.9673  0.1949   1.14   O     = 1.00
  15 0.263   0.7724  0.3026   1.45   O     = 1.00
  16 0.2082  0.8216  0.1974   0.29   O     = 1.00
  17 0.7951  0.9177  0.303    0.95   O     = 1.00
  18 0.228   0.0414  0.1434   2.13   O     = 1.00
  19 0.786   0.7031  0.3494   0.95   O     = 1.00
  20 0.2202  0.0371  0.2338   0.63   O     = 1.00
  21 0.7816  0.7189  0.2529   1.75   O     = 1.00
  22 0.2656  0.8039  0.0814   2.28   O     = 1.00
  23 0.7685  0.9718  0.4207   0.89   O     = 1.00
  24 0.7728  0.9228  0.0788   0.83   O     = 1.00
  25 0.2412  0.8098  0.4199   1.55   O     = 1.00
  26 0.7835  0.7097  0.1274   1.29   O     = 1.00
  27 0.2256  0.0367  0.3682   2.26   O     = 1.00
  28 0.7949  0.7225  0.0379   0.84   O     = 1.00
  29 0.2288  0.0308  0.4674   1.03   O     = 1.00
  30 0.7705  0.973   0.5189   2.03   OH    = 1.00
  31 0.7615  0.2255  0.4704   2.77   OH    = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.998      0.3804     0.25  
     2       2     0.997      0.3725     0.137 
     3       3     0.9961     0.3658     0.3619
     4       4     0.0157     0.0976     0.0817
     5       5     0.0013     0.6494     0.4087
     6       6     0.9987     0.6567     0.1927
     7       7     0.0091     0.091      0.301 
     8       8     0.9813     0.3722     0.0202
     9       9     0.9937     0.3578     0.4782
    10      10     0.0748     0.9681     0.1942
    11      11     0.9353     0.7812     0.3016
    12      12     0.0847     0.9618     0.4171
    13      13     0.9205     0.7773     0.0806
    14      14     0.7435     0.9673     0.1949
    15      15     0.263      0.7724     0.3026
    16      16     0.2082     0.8216     0.1974
    17      17     0.7951     0.9177     0.303 
    18      18     0.228      0.0414     0.1434
    19      19     0.786      0.7031     0.3494
    20      20     0.2202     0.0371     0.2338
    21      21     0.7816     0.7189     0.2529
    22      22     0.2656     0.8039     0.0814
    23      23     0.7685     0.9718     0.4207
    24      24     0.7728     0.9228     0.0788
    25      25     0.2412     0.8098     0.4199
    26      26     0.7835     0.7097     0.1274
    27      27     0.2256     0.0367     0.3682
    28      28     0.7949     0.7225     0.0379
    29      29     0.2288     0.0308     0.4674
    30      30     0.7705     0.973      0.5189
    31      31     0.7615     0.2255     0.4704
    32       1     0.002      0.6196     0.75  
    33       2     0.003      0.6275     0.637 
    34       3     0.0039     0.6342     0.8619
    35       4     0.9843     0.9024     0.5817
    36       5     0.9987     0.3506     0.9087
    37       6     0.0013     0.3433     0.6927
    38       7     0.9909     0.909      0.801 
    39       8     0.0187     0.6278     0.5202
    40       9     0.0063     0.6422     0.9782
    41      10     0.9252     0.0319     0.6942
    42      11     0.0647     0.2188     0.8016
    43      12     0.9153     0.0382     0.9171
    44      13     0.0795     0.2227     0.5806
    45      14     0.2565     0.0327     0.6949
    46      15     0.737      0.2276     0.8026
    47      16     0.7918     0.1784     0.6974
    48      17     0.2049     0.0823     0.803 
    49      18     0.772      0.9586     0.6434
    50      19     0.214      0.2969     0.8494
    51      20     0.7798     0.9629     0.7338
    52      21     0.2184     0.2811     0.7529
    53      22     0.7344     0.1961     0.5814
    54      23     0.2315     0.0282     0.9207
    55      24     0.2272     0.0772     0.5788
    56      25     0.7588     0.1902     0.9199
    57      26     0.2165     0.2903     0.6274
    58      27     0.7744     0.9633     0.8682
    59      28     0.2051     0.2775     0.5379
    60      29     0.7712     0.9692     0.9674
    61      30     0.2295     0.027      0.0189
    62      31     0.2385     0.7745     0.9704
    63       1     0.502      0.8804     0.25  
    64       2     0.503      0.8725     0.137 
    65       3     0.5039     0.8658     0.3619
    66       4     0.4843     0.5976     0.0817
    67       5     0.4987     0.1494     0.4087
    68       6     0.5013     0.1567     0.1927
    69       7     0.4909     0.591      0.301 
    70       8     0.5187     0.8722     0.0202
    71       9     0.5063     0.8578     0.4782
    72      10     0.4252     0.4681     0.1942
    73      11     0.5647     0.2812     0.3016
    74      12     0.4153     0.4618     0.4171
    75      13     0.5795     0.2773     0.0806
    76      14     0.7565     0.4673     0.1949
    77      15     0.237      0.2724     0.3026
    78      16     0.2918     0.3216     0.1974
    79      17     0.7049     0.4177     0.303 
    80      18     0.272      0.5414     0.1434
    81      19     0.714      0.2031     0.3494
    82      20     0.2798     0.5371     0.2338
    83      21     0.7184     0.2189     0.2529
    84      22     0.2344     0.3039     0.0814
    85      23     0.7315     0.4718     0.4207
    86      24     0.7272     0.4228     0.0788
    87      25     0.2588     0.3098     0.4199
    88      26     0.7165     0.2097     0.1274
    89      27     0.2744     0.5367     0.3682
    90      28     0.7051     0.2225     0.0379
    91      29     0.2712     0.5308     0.4674
    92      30     0.7295     0.473      0.5189
    93      31     0.7385     0.7255     0.4704
    94       1     0.498      0.1196     0.75  
    95       2     0.497      0.1275     0.637 
    96       3     0.4961     0.1342     0.8619
    97       4     0.5157     0.4024     0.5817
    98       5     0.5013     0.8506     0.9087
    99       6     0.4987     0.8433     0.6927
   100       7     0.5091     0.409      0.801 
   101       8     0.4813     0.1278     0.5202
   102       9     0.4937     0.1422     0.9782
   103      10     0.5748     0.5319     0.6942
   104      11     0.4353     0.7188     0.8016
   105      12     0.5847     0.5382     0.9171
   106      13     0.4205     0.7227     0.5806
   107      14     0.2435     0.5327     0.6949
   108      15     0.763      0.7276     0.8026
   109      16     0.7082     0.6784     0.6974
   110      17     0.2951     0.5823     0.803 
   111      18     0.728      0.4586     0.6434
   112      19     0.286      0.7969     0.8494
   113      20     0.7202     0.4629     0.7338
   114      21     0.2816     0.7811     0.7529
   115      22     0.7656     0.6961     0.5814
   116      23     0.2685     0.5282     0.9207
   117      24     0.2728     0.5772     0.5788
   118      25     0.7412     0.6902     0.9199
   119      26     0.2835     0.7903     0.6274
   120      27     0.7256     0.4633     0.8682
   121      28     0.2949     0.7775     0.5379
   122      29     0.7288     0.4692     0.9674
   123      30     0.2705     0.527      0.0189
   124      31     0.2615     0.2745     0.9704


X-ray density (g/cm cub.)   =      4.05

MU (1/cm) =     681.789    Mass attenuation coefficient (cm**2/g) =    168.445

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

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

    1    Mn                  2.772        6
                                                 2.1594      14
                                                 2.2119      15
                                                 2.1552      16
                                                 2.1052      17
                                                 2.2162      20
                                                 2.2036      21
    2    Mn                  2.772        6
                                                 2.2511      14
                                                 2.2934      16
                                                 2.2586      18
                                                 2.0818      22
                                                 2.1702      24
                                                 2.2322      26
    3    Mn                  2.772        6
                                                 2.2742      15
                                                 2.2537      17
                                                 2.2475      19
                                                 2.3871      23
                                                 2.1613      25
                                                 2.2851      27
    4    Mn                  2.772        6
                                                 2.111       18
                                                 2.2165      24
                                                 2.1886      30
                                                 2.4531      22
                                                 2.2863      26
                                                 2.3675      28
    5    Mn                  2.772        6
                                                 2.0554      19
                                                 2.1019      25
                                                 2.337       23
                                                 2.1288      27
                                                 2.4659      29
                                                 2.3084      31
    6    Mn                  2.772        6
                                                 2.0443      16
                                                 2.1075      21
                                                 2.1929      26
                                                 2.3477      14
                                                 2.2869      18
                                                 2.2045      20
    7    Mn                  2.772        6
                                                 2.1297      17
                                                 2.2312      20
                                                 2.2446      27
                                                 2.2383      15
                                                 2.3175      19
                                                 2.392       21
    8    Mn                  2.772        6
                                                 2.2431      22
                                                 2.1343      24
                                                 2.1522      28
                                                 2.1927      29
                                                 2.1765      30
                                                 2.2204      31
    9    Mn                  2.772        6
                                                 1.8267      31
                                                 2.1522      28
                                                 2.3979      23
                                                 2.1526      25
                                                 2.3141      29
                                                 2.1204      30
   10    Si                  2.148        4
                                                 1.6152      14
                                                 1.7007      16
                                                 1.7953      18
                                                 1.5145      20
   11    Si                  2.148        4
                                                 1.6006      15
                                                 1.6142      17
                                                 1.7446      19
                                                 1.7         21
   12    Si                  2.148        4
                                                 1.5485      23
                                                 1.7994      25
                                                 1.7361      27
                                                 1.746       29
   13    Si                  2.148        4
                                                 1.7065      22
                                                 1.7172      24
                                                 1.646       26
                                                 1.4721      28
   14    O                   3.312       11
                                                 2.7517      16
                                                 3.0413      16
                                                 3.1024      17
                                                 2.8835      18
                                                 3.0085      18
                                                 2.676       20
                                                 2.8755      20
                                                 3.1276      21
                                                 3.3093      24
                                                 3.1537      21
                                                 3.2209      26
   15    O                   3.312        9
                                                 3.0228      16
                                                 3.0249      17
                                                 2.7612      17
                                                 2.9649      19
                                                 2.7744      19
                                                 2.9464      21
                                                 2.7924      21
                                                 3.1804      20
                                                 3.1291      27
   16    O                   3.312        9
                                                 3.0413      14
                                                 2.7517      14
                                                 3.0228      15
                                                 2.8046      18
                                                 2.5262      20
                                                 2.825       21
                                                 3.2863      22
                                                 3.1006      26
                                                 3.2336      20
   17    O                   3.312        7
                                                 3.1024      14
                                                 2.7612      15
                                                 3.0249      15
                                                 2.6445      19
                                                 3.1197      20
                                                 2.5554      21
                                                 3.0666      27
   18    O                   3.312        9
                                                 3.0085      14
                                                 2.8835      14
                                                 2.8046      16
                                                 2.5482      20
                                                 3.0911      22
                                                 3.1387      24
                                                 3.31        22
                                                 3.0204      26
                                                 3.1096      26
   19    O                   3.312        8
                                                 2.7744      15
                                                 2.9649      15
                                                 2.6445      17
                                                 2.7247      21
                                                 3.1901      25
                                                 3.2005      23
                                                 3.0208      27
                                                 3.1107      27
   20    O                   3.312        9
                                                 2.8755      14
                                                 2.676       14
                                                 2.5262      16
                                                 3.1197      17
                                                 2.5482      18
                                                 3.1804      15
                                                 3.2336      16
                                                 3.1589      21
                                                 3.1724      21
   21    O                   3.312        9
                                                 3.1276      14
                                                 2.7924      15
                                                 2.9464      15
                                                 2.825       16
                                                 2.5554      17
                                                 2.7247      19
                                                 3.1537      14
                                                 3.1589      20
                                                 3.1724      20
   22    O                   3.312       11
                                                 3.2863      16
                                                 3.0911      18
                                                 2.7822      24
                                                 2.72        24
                                                 3.012       26
                                                 2.8673      26
                                                 2.9868      28
                                                 2.7437      28
                                                 2.9734      30
                                                 3.1466      31
                                                 3.31        18
   23    O                   3.312       10
                                                 2.8845      25
                                                 3.1013      25
                                                 2.7636      27
                                                 3.1107      27
                                                 2.677       29
                                                 3.0089      29
                                                 2.7673      30
                                                 3.0568      31
                                                 3.2005      19
                                                 2.99        31
   24    O                   3.312        8
                                                 3.3093      14
                                                 3.1387      18
                                                 2.72        22
                                                 2.7822      22
                                                 2.662       26
                                                 2.4374      28
                                                 3.1783      29
                                                 3.0086      30
   25    O                   3.312        9
                                                 3.1901      19
                                                 3.1013      23
                                                 2.8845      23
                                                 2.8342      27
                                                 2.7197      29
                                                 3.2714      27
                                                 3.2772      29
                                                 2.9526      31
                                                 2.9742      31
   26    O                   3.312        8
                                                 3.1006      16
                                                 2.8673      22
                                                 3.012       22
                                                 2.662       24
                                                 2.5264      28
                                                 3.2209      14
                                                 3.0204      18
                                                 3.1096      18
   27    O                   3.312        9
                                                 3.0666      17
                                                 3.1107      23
                                                 2.7636      23
                                                 2.8342      25
                                                 2.7962      29
                                                 3.1292      15
                                                 3.0208      19
                                                 3.1107      19
                                                 3.2714      25
   28    O                   3.312        7
                                                 2.7437      22
                                                 2.9868      22
                                                 2.4374      24
                                                 2.5264      26
                                                 3.3076      29
                                                 2.9334      31
                                                 3.1695      30
   29    O                   3.312       10
                                                 3.0089      23
                                                 2.677       23
                                                 2.7197      25
                                                 2.7962      27
                                                 3.0762      30
                                                 2.7351      30
                                                 3.0894      31
                                                 3.1783      24
                                                 3.3076      28
                                                 3.2772      25
   30    OH                  3.36        10
                                                 2.7673      23
                                                 2.7351      29
                                                 3.0762      29
                                                 3.0301      31
                                                 2.9734      22
                                                 3.0086      24
                                                 3.3331      24
                                                 2.9862      31
                                                 3.3474      28
                                                 3.1695      28
   31    OH                  3.36        11
                                                 3.0568      23
                                                 3.0894      29
                                                 3.3314      29
                                                 3.0301      30
                                                 3.1466      22
                                                 2.9334      28
                                                 3.3594      28
                                                 2.99        23
                                                 2.9526      25
                                                 2.9742      25
                                                 2.9862      30

  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   2  3.134   6.268   0.035  666.21    2       28.2       49.0
    2   0   0   4  6.277  12.554   0.071  164.33    2        5.1        0.4
    3   0   2   0  8.271  16.542   0.093   93.7     2       31.0        8.3
    4   0   2   1  8.42   16.84    0.095   90.33    4       85.4      121.7
    5   0   2   2  8.853  17.705   0.1     81.51    4       17.6        4.7
    6   1   0   1  9.227  18.455   0.104   74.85    4       31.3       13.6
    7   0   0   6  9.439  18.879   0.106   71.43    2       51.4       17.4
    8   0   2   3  9.531  19.063   0.107   70.02    4       18.7        4.5
    9   1   1   0  9.998  19.995   0.113   63.44    4      121.8      174.0
   10   1   1   1 10.122  20.244   0.114   61.84    8       49.1       55.0
   11   1   0   3 10.254  20.509   0.116   60.2     4       49.5       27.2
   12   0   2   4 10.41   20.82    0.117   58.35    4      115.7      144.4
   13   1   1   2 10.487  20.974   0.118   57.46    8       53.4       60.7
   14   1   1   3 11.07   22.139   0.125   51.36    8       57.4       62.6
   15   0   2   5 11.445  22.89    0.129   47.91    4       35.0       10.9
   16   1   1   4 11.839  23.679   0.133   44.63    8      150.6      374.0
   17   1   0   5 12.059  24.117   0.136   42.95    4      112.4      100.3
   18   1   2   0 12.338  24.677   0.139   40.93    4       27.7        5.8
   19   1   2   1 12.44   24.881   0.14    40.23    8       77.8       90.0
   20   0   2   6 12.601  25.202   0.142   39.16    4       48.5       17.0
   21   0   0   8 12.631  25.262   0.142   38.96    2       78.2       22.0
   22   1   2   2 12.742  25.485   0.143   38.25    8       12.0        2.0
   23   1   1   5 12.765  25.53    0.143   38.1     8      164.6      381.7
   24   1   2   3 13.231  26.462   0.149   35.33    8       35.9       16.9
   25   1   1   6 13.817  27.634   0.155   32.23    8      134.4      215.2
   26   0   2   7 13.85   27.701   0.155   32.06    4       19.4        2.2
   27   1   2   4 13.888  27.777   0.156   31.88    8       58.6       40.5
   28   1   0   7 14.368  28.736   0.161   29.65    4       22.0        2.7
   29   1   2   5 14.694  29.388   0.165   28.27    8       21.4        4.8
   30   1   1   7 14.973  29.946   0.168   27.15    8        9.1        0.8
   31   0   2   8 15.174  30.348   0.17    26.39    4       32.3        5.1
   32   1   3   0 15.513  31.025   0.174   25.16    4      448.0      933.3
   33   1   3   1 15.595  31.191   0.175   24.88    8      269.5      668.0
   34   1   2   6 15.627  31.253   0.175   24.77    8       24.3        5.4
   35   1   3   2 15.842  31.683   0.177   24.05    8       52.8       24.8
   36   0   0  10 15.863  31.727   0.177   23.98    2      211.4       99.0
   37   1   1   8 16.213  32.426   0.181   22.88    8      292.4      722.8
   38   1   3   3 16.245  32.489   0.182   22.78    8      127.7      137.3
   39   0   2   9 16.558  33.116   0.185   21.86    4      376.0      571.0
   40   1   2   7 16.668  33.337   0.186   21.54    8       20.5        3.3
   41   0   4   0 16.721  33.442   0.187   21.4     2      292.0      168.6
   42   1   3   4 16.794  33.588   0.188   21.19    8      231.3      419.1
   43   0   4   1 16.799  33.597   0.188   21.18    4       34.6        4.7
   44   1   0   9 17.001  34.001   0.19    20.64    4       33.0        4.1
   45   0   4   2 17.029  34.059   0.19    20.56    4       12.6        0.6
   46   0   4   3 17.408  34.816   0.194   19.6     4       97.4       34.3
   47   1   3   5 17.478  34.957   0.195   19.43    8      241.5      418.8
   48   1   1   9 17.524  35.047   0.195   19.32    8      369.4      974.5
   49   1   2   8 17.803  35.606   0.198   18.66    8        6.0        0.3
   50   0   4   4 17.926  35.852   0.2     18.38    4       22.7        1.8
   51   0   2  10 17.992  35.984   0.201   18.24    4       45.9        7.1
   52   1   3   6 18.284  36.568   0.204   17.6     8      139.5      126.6
   53   2   0   0 18.422  36.844   0.205   17.31    2      366.7      215.1
   54   0   4   5 18.574  37.147   0.207   17.0     4      245.4      189.2
   55   2   0   2 18.706  37.411   0.208   16.74    4       25.6        2.0
   56   1   1  10 18.894  37.788   0.21    16.38    8      173.8      182.8
   57   2   1   0 18.911  37.821   0.21    16.34    4       78.3       18.5
   58   2   1   1 18.98   37.961   0.211   16.21    8       69.2       28.7
   59   1   2   9 19.017  38.035   0.212   16.14    8      216.3      279.1
   60   0   0  12 19.148  38.296   0.213   15.9     2       47.5        3.3
   61   1   4   0 19.162  38.325   0.213   15.87    4      241.7      171.4
   62   2   1   2 19.188  38.377   0.213   15.83    8       25.6        3.8
   63   1   3   7 19.199  38.398   0.213   15.81    8       12.4        0.9
   64   1   4   1 19.231  38.462   0.214   15.75    8        7.8        0.4
   65   0   4   6 19.34   38.68    0.215   15.55    4       40.5        4.7
   66   1   4   2 19.437  38.874   0.216   15.38    8       16.4        1.5
   67   0   2  11 19.47   38.941   0.216   15.32    4        9.3        0.2
   68   2   1   3 19.53   39.061   0.217   15.22    8       39.1        8.6
   69   2   0   4 19.536  39.071   0.217   15.21    4       18.6        1.0
   70   1   4   3 19.775  39.551   0.22    14.8     8       25.2        3.5
   71   1   0  11 19.856  39.713   0.22    14.67    4       18.0        0.9
   72   2   1   4 20.001  40.003   0.222   14.43    8      112.6       67.6
   73   1   3   8 20.21   40.421   0.224   14.1     8      141.4      104.2
   74   0   4   7 20.214  40.428   0.224   14.1     4       40.2        4.2
   75   1   4   4 20.241  40.483   0.225   14.06    8        9.6        0.5
   76   1   2  10 20.301  40.602   0.225   13.96    8       26.2        3.6
   77   1   1  11 20.316  40.632   0.225   13.94    8       34.5        6.1
   78   2   2   0 20.317  40.634   0.225   13.94    4       26.6        1.8
   79   2   2   1 20.383  40.765   0.226   13.84    8       19.2        1.9
   80   2   2   2 20.579  41.157   0.228   13.55    8       25.0        3.1
   81   2   1   5 20.593  41.187   0.228   13.53    8       80.1       32.1
   82   1   4   5 20.828  41.656   0.231   13.19    8       22.1        2.4
   83   2   0   6 20.857  41.714   0.231   13.15    4       17.9        0.8
   84   2   2   3 20.902  41.804   0.232   13.08    8       12.5        0.8
   85   0   2  12 20.988  41.976   0.232   12.96    4       26.2        1.6
   86   0   4   8 21.185  42.37    0.235   12.69    4      161.6       61.3
   87   2   1   6 21.299  42.597   0.236   12.54    8       53.1       13.1
   88   1   3   9 21.308  42.617   0.236   12.53    8      119.3       66.0
   89   2   2   4 21.347  42.695   0.236   12.48    8       68.0       21.3
   90   1   4   6 21.527  43.054   0.238   12.25    8        6.8        0.2
   91   1   2  11 21.646  43.292   0.239   12.1     8       19.4        1.7
   92   1   1  12 21.785  43.57    0.241   11.92    8       44.6        8.8
   93   2   2   5 21.91   43.819   0.242   11.77    8       27.4        3.3
   94   2   1   7 22.109  44.217   0.244   11.53    8       16.5        1.2
   95   0   4   9 22.244  44.488   0.246   11.38    4       36.9        2.9
   96   1   4   7 22.33   44.66    0.247   11.28    8       24.4        2.5
   97   1   3  10 22.484  44.967   0.248   11.1     8       34.5        4.9
   98   2   3   0 22.498  44.997   0.248   11.09    4       72.1       10.7
   99   0   0  14 22.5    45.0     0.248   11.09    2      109.1       12.2
  100   0   2  13 22.542  45.084   0.249   11.04    4       28.3        1.6
  101   2   3   1 22.559  45.118   0.249   11.02    8       37.6        5.8
  102   2   2   6 22.582  45.163   0.249   11.0     8       51.1       10.6
  103   2   0   8 22.6    45.2     0.249   10.98    4       61.7        7.7
  104   2   3   2 22.74   45.479   0.251   10.82    8        8.3        0.3
  105   1   0  13 22.886  45.771   0.252   10.67    4       35.6        2.5
  106   2   1   8 23.015  46.029   0.254   10.53    8       39.3        6.0
  107   2   3   3 23.038  46.077   0.254   10.51    8       16.7        1.1
  108   1   2  12 23.046  46.093   0.254   10.5     8       43.2        7.2
  109   1   5   0 23.13   46.26    0.255   10.42    4      110.1       23.3
  110   1   5   1 23.189  46.379   0.256   10.36    8       80.9       25.1
  111   1   4   8 23.229  46.459   0.256   10.31    8       29.8        3.4
  112   1   1  13 23.296  46.593   0.257   10.25    8      112.6       48.0
  113   2   2   7 23.356  46.712   0.257   10.19    8       14.7        0.8
  114   1   5   2 23.366  46.732   0.257   10.18    8        8.0        0.2
  115   0   4  10 23.382  46.764   0.258   10.16    4       37.9        2.7
  116   2   3   4 23.451  46.903   0.258   10.1     8        5.1        0.1
  117   1   5   3 23.659  47.317   0.26     9.9     8       65.9       15.9
  118   1   3  11 23.729  47.458   0.261    9.83    8       53.6       10.4
  119   2   3   5 23.975  47.949   0.264    9.6     8       12.9        0.6
  120   2   1   9 24.009  48.019   0.264    9.57    8       14.4        0.7
  121   1   5   4 24.064  48.128   0.265    9.52    8       98.8       34.3
  122   0   2  14 24.131  48.262   0.265    9.46    4       54.9        5.3
  123   1   4   9 24.217  48.435   0.266    9.39    8       17.3        1.0
  124   2   2   8 24.226  48.452   0.266    9.38    8       23.6        1.9
  125   1   2  13 24.497  48.994   0.269    9.14    8       29.6        3.0
  126   1   5   5 24.577  49.154   0.27     9.08    8      100.1       33.6
  127   0   4  11 24.592  49.184   0.27     9.06    4       60.4        6.1
  128   2   3   6 24.603  49.205   0.27     9.05    8       19.8        1.3
  129   2   0  10 24.698  49.395   0.271    8.98    4      142.1       33.5
  130   1   1  14 24.848  49.697   0.273    8.85    8      141.4       65.4
  131   1   3  12 25.038  50.077   0.275    8.7     8       61.5       12.2
  132   2   1  10 25.086  50.171   0.275    8.66    8       30.0        2.9
  133   2   2   9 25.184  50.369   0.276    8.59    8      607.2     1169.9
  134   1   5   6 25.194  50.388   0.276    8.58    8       56.2       10.0
  135   1   4  10 25.287  50.574   0.277    8.51    8       22.4        1.6
  136   2   4   0 25.301  50.601   0.277    8.5     4      536.3      451.5
  137   2   3   7 25.33   50.66    0.278    8.47    8        3.1        0.0
  138   2   4   1 25.356  50.712   0.278    8.45    8       22.5        1.6
  139   2   4   2 25.521  51.043   0.28     8.33    8       36.4        4.1
  140   0   6   0 25.567  51.134   0.28     8.3     2       40.6        1.3
  141   0   6   1 25.622  51.244   0.281    8.25    4       44.7        3.0
  142   0   2  15 25.755  51.509   0.282    8.16    4       75.7        8.6
  143   0   6   2 25.786  51.573   0.282    8.14    4       63.8        6.1
  144   2   4   3 25.796  51.591   0.282    8.13    8      105.2       33.3
  145   0   4  12 25.869  51.738   0.283    8.08    4       40.2        2.4
  146   1   5   7 25.909  51.818   0.284    8.05    8       28.6        2.4
  147   0   0  16 25.935  51.87    0.284    8.03    2       54.8        2.2
  148   1   2  14 25.995  51.991   0.285    7.99    8       87.5       22.6
  149   0   6   3 26.059  52.117   0.285    7.94    4       31.2        1.4
  150   1   0  15 26.066  52.132   0.285    7.94    4       29.4        1.3
  151   2   3   8 26.151  52.301   0.286    7.88    8       30.4        2.7
  152   2   4   4 26.176  52.352   0.286    7.86    8       41.2        4.9
  153   2   2  10 26.225  52.45    0.287    7.83    8       25.4        1.9
  154   2   1  11 26.237  52.475   0.287    7.82    8       20.7        1.2
  155   1   3  13 26.407  52.814   0.289    7.71    8      184.5       96.9
  156   1   4  11 26.432  52.865   0.289    7.69    8       28.2        2.3
  157   0   6   4 26.436  52.873   0.289    7.69    4      312.3      138.5
  158   1   1  15 26.44   52.879   0.289    7.69    8      107.4       32.8
  159   2   4   5 26.66   53.319   0.291    7.54    8      240.5      161.2
  160   1   5   8 26.717  53.434   0.292    7.5     8      169.6       79.8
  161   0   6   5 26.917  53.833   0.294    7.38    4       42.5        2.5
  162   2   3   9 27.059  54.119   0.295    7.29    8       72.2       14.0
  163   2   0  12 27.095  54.191   0.296    7.27    4       50.3        3.4
  164   0   4  13 27.208  54.416   0.297    7.2     4      260.8       90.5
  165   2   4   6 27.242  54.485   0.297    7.18    8       37.7        3.8
  166   2   2  11 27.343  54.685   0.298    7.12    8       13.3        0.5
  167   1   6   0 27.36   54.721   0.298    7.11    4       27.0        1.0
  168   1   6   1 27.413  54.825   0.299    7.08    8       51.1        6.8
  169   0   2  16 27.413  54.826   0.299    7.08    4       17.6        0.4
  170   2   1  12 27.459  54.918   0.299    7.05    8       38.0        3.8
  171   0   6   6 27.496  54.991   0.3      7.03    4      178.2       41.3
  172   1   2  15 27.539  55.078   0.3      7.0     8       12.2        0.4
  173   1   6   2 27.57   55.139   0.3      6.99    8        9.5        0.2
  174   1   5   9 27.613  55.226   0.301    6.96    8      259.9      173.8
  175   1   4  12 27.648  55.297   0.301    6.94    8       15.1        0.6
  176   1   6   3 27.83   55.659   0.303    6.84    8       23.9        1.4
  177   1   3  14 27.832  55.663   0.303    6.84    8      196.2       97.3
  178   2   4   7 27.92   55.841   0.304    6.79    8       40.4        4.1
  179   2   3  10 28.051  56.102   0.305    6.72    8       26.4        1.7
  180   1   1  16 28.07   56.139   0.305    6.71    8       23.7        1.4
  181   0   6   7 28.17   56.339   0.306    6.65    4        4.1        0.0
  182   1   6   4 28.191  56.382   0.307    6.64    8       11.2        0.3
  183   3   0   1 28.347  56.693   0.308    6.56    4       34.0        1.4
  184   2   2  12 28.532  57.064   0.31     6.46    8       19.0        0.9
  185   1   5  10 28.592  57.183   0.311    6.43    8      126.9       38.3
  186   2   5   0 28.604  57.208   0.311    6.43    4       46.9        2.6
  187   0   4  14 28.605  57.21    0.311    6.43    4       22.8        0.6
  188   3   1   0 28.649  57.298   0.311    6.4     4      199.3       47.0
  189   1   6   5 28.651  57.302   0.311    6.4     8       42.2        4.2
  190   2   5   1 28.655  57.31    0.311    6.4     8       21.6        1.1
  191   2   4   8 28.69   57.379   0.312    6.38    8      156.4       57.7
  192   3   1   1 28.7    57.4     0.312    6.38    8      113.9       30.6
  193   2   1  13 28.747  57.494   0.312    6.35    8       51.7        6.3
  194   3   0   3 28.755  57.509   0.312    6.35    4       56.3        3.7
  195   2   5   2 28.807  57.615   0.313    6.32    8       18.1        0.8
  196   3   1   2 28.852  57.704   0.313    6.3     8       34.2        2.7
  197   1   4  13 28.931  57.861   0.314    6.26    8       43.1        4.3
  198   0   6   8 28.934  57.869   0.314    6.26    4       54.0        3.4
  199   2   5   3 29.06   58.12    0.315    6.2     8       37.9        3.3
  200   3   1   3 29.105  58.209   0.316    6.18    8       64.8        9.6
  201   0   2  17 29.107  58.214   0.316    6.18    4      212.7       51.7
  202   2   3  11 29.121  58.242   0.316    6.17    8        0.2        0.0
  203   1   2  16 29.128  58.256   0.316    6.17    8       10.5        0.2
  204   1   6   6 29.207  58.415   0.317    6.13    8        8.3        0.2
  205   1   3  15 29.31   58.62    0.318    6.08    8      122.5       33.7
  206   1   0  17 29.394  58.788   0.319    6.04    4        5.6        0.0
  207   2   5   4 29.412  58.823   0.319    6.04    8       79.4       14.1
  208   3   1   4 29.456  58.912   0.319    6.02    8      140.1       43.7
  209   0   0  18 29.473  58.946   0.319    6.01    2      740.0      304.0
  210   2   4   9 29.546  59.091   0.32     5.97    8       31.0        2.1
  211   3   0   5 29.56   59.119   0.32     5.97    4       59.0        3.8
  212   1   5  11 29.649  59.298   0.321    5.93    8       25.7        1.4
  213   3   2   0 29.694  59.388   0.322    5.91    4       49.2        2.6
  214   1   1  17 29.739  59.479   0.322    5.89    8      127.5       35.4
  215   3   2   1 29.744  59.487   0.322    5.89    8       80.5       14.1
  216   2   0  14 29.755  59.51    0.322    5.88    4       31.6        1.1
  217   0   6   9 29.786  59.572   0.322    5.87    4      626.0      424.9
  218   2   2  13 29.79   59.58    0.322    5.87    8       21.1        1.0
  219   1   6   7 29.856  59.712   0.323    5.84    8       26.5        1.5
  220   2   5   5 29.86   59.72    0.323    5.83    8       68.7       10.2
  221   3   2   2 29.892  59.785   0.324    5.82    8       24.3        1.3
  222   3   1   5 29.904  59.807   0.324    5.82    8      126.5       34.4
  223   0   4  15 30.059  60.118   0.325    5.75    4      162.2       28.0
  224   2   1  14 30.098  60.196   0.326    5.73    8       63.1        8.4
  225   3   2   3 30.14   60.279   0.326    5.71    8       27.5        1.6
  226   2   3  12 30.265  60.53    0.327    5.66    8       24.6        1.3
  227   1   4  14 30.276  60.553   0.327    5.66    8       19.6        0.8
  228   2   5   6 30.402  60.804   0.328    5.6     8       22.1        1.0
  229   3   1   6 30.446  60.891   0.329    5.59    8       81.0       13.6
  230   3   2   4 30.483  60.967   0.329    5.57    8       66.2        9.0
  231   2   4  10 30.485  60.969   0.329    5.57    8       39.1        3.1
  232   1   6   8 30.594  61.189   0.33     5.53    8       17.2        0.6
  233   0   6  10 30.721  61.441   0.332    5.48    4       36.1        1.3
  234   3   0   7 30.742  61.485   0.332    5.47    4       17.2        0.3
  235   1   2  17 30.761  61.522   0.332    5.46    8       25.6        1.3
  236   1   5  12 30.781  61.562   0.332    5.45    8       37.7        2.9
  237   0   2  18 30.838  61.677   0.333    5.43    4       14.2        0.2
  238   1   3  16 30.84   61.68    0.333    5.43    8       17.1        0.6
  239   3   2   5 30.922  61.845   0.334    5.4     8       26.4        1.4
  240   2   5   7 31.036  62.072   0.335    5.35    8        5.7        0.1
  241   3   1   7 31.079  62.157   0.335    5.34    8       18.0        0.6
  242   2   2  14 31.113  62.225   0.335    5.32    8       22.9        1.0
  243   3   3   0 31.387  62.775   0.338    5.22    4      238.7       55.0
  244   1   6   9 31.419  62.837   0.338    5.21    8       16.1        0.5
  245   3   3   1 31.436  62.871   0.339    5.2     8      149.2       42.8
  246   1   1  18 31.45   62.899   0.339    5.2     8       57.5        6.4
  247   3   2   6 31.454  62.908   0.339    5.2     8       16.3        0.5
  248   2   3  13 31.48   62.96    0.339    5.19    8       13.7        0.4
  249   2   4  11 31.503  63.006   0.339    5.18    8       27.5        1.5
  250   2   1  15 31.509  63.019   0.339    5.18    8       33.9        2.2
  251   0   4  16 31.567  63.135   0.34     5.16    4       42.3        1.7
  252   3   3   2 31.58   63.159   0.34     5.15    8       14.8        0.4
  253   1   4  15 31.683  63.366   0.341    5.12    8       25.1        1.2
  254   0   6  11 31.735  63.469   0.341    5.1     4       15.6        0.2
  255   2   5   8 31.758  63.516   0.342    5.09    8       23.9        1.1
  256   3   1   8 31.8    63.6     0.342    5.07    8      158.6       47.2
  257   3   3   3 31.819  63.638   0.342    5.07    8       71.2        9.5
  258   1   7   0 31.851  63.702   0.343    5.06    4      395.0      145.8
  259   1   7   1 31.898  63.797   0.343    5.04    8      212.6       84.2
  260   1   5  13 31.985  63.97    0.344    5.01    8       39.2        2.8
  261   1   7   2 32.041  64.083   0.344    4.99    8       35.7        2.3
  262   3   2   7 32.075  64.151   0.345    4.98    8       15.7        0.5
  263   3   3   4 32.153  64.305   0.345    4.95    8      136.1       33.9
  264   1   7   3 32.279  64.558   0.347    4.91    8       24.3        1.1
  265   3   0   9 32.28   64.56    0.347    4.91    4       60.0        3.3
  266   1   6  10 32.326  64.651   0.347    4.9     8       21.8        0.9
  267   2   6   0 32.337  64.674   0.347    4.89    4       34.6        1.1
  268   2   6   1 32.384  64.769   0.348    4.88    8       11.7        0.2
  269   1   3  17 32.422  64.844   0.348    4.87    8      206.4       76.6
  270   1   2  18 32.44   64.88    0.348    4.86    8       20.8        0.8
  271   2   2  15 32.499  64.997   0.349    4.84    8       33.9        2.1
  272   2   6   2 32.526  65.052   0.349    4.83    8       42.1        3.2
  273   2   5   9 32.565  65.131   0.349    4.82    8       30.5        1.7
  274   3   3   5 32.579  65.157   0.35     4.82    8      147.5       38.7
  275   2   4  12 32.597  65.195   0.35     4.81    8       10.6        0.2
  276   3   1   9 32.607  65.214   0.35     4.81    8      222.9       88.3
  277   0   2  19 32.609  65.218   0.35     4.81    4       84.0        6.3
  278   1   7   4 32.61   65.22    0.35     4.81    8       18.3        0.6
  279   2   0  16 32.654  65.309   0.35     4.79    4       44.4        1.7
  280   2   6   3 32.762  65.524   0.351    4.76    8       13.0        0.3
  281   2   3  14 32.764  65.527   0.351    4.76    8       19.5        0.7
  282   3   2   8 32.785  65.57    0.351    4.75    8       10.1        0.2
  283   0   6  12 32.825  65.65    0.352    4.74    4      104.5        9.6
  284   1   0  19 32.878  65.756   0.352    4.72    4       31.7        0.9
  285   2   1  16 32.98   65.96    0.353    4.69    8        7.3        0.1
  286   1   7   5 33.033  66.066   0.354    4.67    8       57.7        5.8
  287   2   6   4 33.09   66.18    0.354    4.66    8      138.7       33.1
  288   3   3   6 33.095  66.191   0.354    4.66    8       89.2       13.7
  289   0   4  17 33.13   66.26    0.355    4.65    4       49.1        2.1
  290   0   0  20 33.14   66.28    0.355    4.64    2       49.7        1.1
  291   1   4  16 33.15   66.299   0.355    4.64    8        3.9        0.0
  292   1   1  19 33.202  66.405   0.355    4.62    8       51.5        4.5
  293   1   5  14 33.258  66.516   0.356    4.61    8       53.9        5.0
  294   1   6  11 33.312  66.625   0.356    4.59    8       19.3        0.6
  295   2   5  10 33.456  66.911   0.358    4.55    8       19.9        0.7
  296   3   1  10 33.497  66.994   0.358    4.54    8       86.0       12.4
  297   2   6   5 33.51   67.02    0.358    4.53    8       12.6        0.3
  298   1   7   6 33.546  67.092   0.359    4.52    8       28.4        1.3
  299   3   2   9 33.579  67.159   0.359    4.51    8      248.4      103.0
  300   3   4   0 33.676  67.353   0.36     4.49    4      209.9       36.6
  301   3   3   7 33.701  67.402   0.36     4.48    8       19.5        0.6
  302   3   4   1 33.723  67.446   0.36     4.47    8       21.3        0.8
  303   2   4  13 33.766  67.532   0.361    4.46    8      122.5       24.8
  304   3   4   2 33.862  67.723   0.362    4.44    8        7.0        0.1
  305   2   2  16 33.947  67.893   0.362    4.41    8       13.9        0.3
  306   0   6  13 33.989  67.979   0.363    4.4     4       24.4        0.5
  307   2   6   6 34.02   68.039   0.363    4.39    8       91.3       13.5
  308   1   3  18 34.056  68.113   0.364    4.38    8      243.8       96.3
  309   3   4   3 34.093  68.185   0.364    4.37    8       49.2        3.9
  310   2   3  15 34.114  68.227   0.364    4.37    8        9.1        0.1
  311   1   7   7 34.148  68.295   0.364    4.36    8       20.4        0.7
  312   3   0  11 34.148  68.297   0.364    4.36    4       37.5        1.1
  313   1   2  19 34.166  68.332   0.365    4.35    8       29.0        1.4
  314   1   6  12 34.377  68.754   0.367    4.3     8       34.4        1.9
  315   3   3   8 34.393  68.786   0.367    4.3     8       72.2        8.3
  316   3   4   4 34.415  68.829   0.367    4.29    8       29.1        1.3
  317   0   2  20 34.423  68.846   0.367    4.29    4       28.8        0.7
  318   2   5  11 34.426  68.852   0.367    4.29    8       15.5        0.4
  319   3   2  10 34.456  68.913   0.367    4.28    8       10.7        0.2
  320   3   1  11 34.467  68.933   0.367    4.28    8       19.0        0.6
  321   2   1  17 34.509  69.019   0.368    4.27    8       47.1        3.5
  322   1   5  15 34.598  69.197   0.369    4.24    8      105.0       17.3
  323   2   6   7 34.617  69.234   0.369    4.24    8       17.1        0.5
  324   1   4  17 34.675  69.35    0.369    4.22    8       16.1        0.4
  325   0   4  18 34.748  69.496   0.37     4.21    4      207.5       33.5
  326   3   4   5 34.827  69.653   0.371    4.19    8      112.3       19.5
  327   1   7   8 34.835  69.671   0.371    4.18    8       20.6        0.7


  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   2   3.134   6.268 14.09          49.0      4.2      4.3     5.5
    2   0   2   1   8.42   16.84   5.26038      121.7     10.3     10.6     5.6
    3   1   0   1   9.227  18.455  4.80365       13.6      1.1      1.2     5.6
    4   0   0   6   9.439  18.879  4.69667       17.4      1.5      1.5     5.6
    5   1   1   0   9.998  19.995  4.4369       174.0     14.7     15.2     5.6
    6   1   1   1  10.122  20.244  4.38291       55.0      4.7      4.8     5.6
    7   1   0   3  10.254  20.509  4.32698       27.2      2.3      2.4     5.6
    8   0   2   4  10.41   20.82   4.26296      144.4     12.2     12.6     5.6
    9   1   1   2  10.487  20.974  4.23203       60.7      5.1      5.3     5.6
   10   1   1   3  11.07   22.139  4.01187       62.6      5.3      5.4     5.6
   11   1   1   4  11.839  23.679  3.75437      374.0     31.7     32.5     5.6
   12   1   0   5  12.059  24.117  3.68707      100.3      8.5      8.7     5.6
   13   1   2   1  12.44   24.881  3.57563       90.0      7.6      7.8     5.6
   14   0   2   6  12.601  25.202  3.53085       17.0      1.4      1.5     5.6
   15   0   0   8  12.631  25.262  3.5225        22.0      1.9      1.9     5.6
   16   1   1   5  12.765  25.53   3.48623      383.8     32.5     33.3     5.6
   17   1   2   3  13.231  26.462  3.36546       16.9      1.4      1.5     5.6
   18   1   1   6  13.817  27.634  3.22529      215.2     18.2     18.7     5.6
   19   1   2   4  13.888  27.777  3.20907       40.5      3.4      3.5     5.6
   20   1   3   0  15.513  31.025  2.8801       933.3     79.1     80.7     5.6
   21   1   3   1  15.595  31.191  2.86517      668.0     56.6     57.7     5.6
   22   0   0  10  15.863  31.727  2.818        123.8     10.5     10.7     5.6
   23   1   1   8  16.213  32.426  2.75879      722.8     61.3     62.4     5.6
   24   1   3   3  16.245  32.489  2.75357      137.3     11.6     11.9     5.6
   25   0   2   9  16.558  33.116  2.70291      571.0     48.4     49.3     5.6
   26   0   4   0  16.721  33.442  2.67725      168.6     14.3     14.5     5.7
   27   1   3   4  16.794  33.588  2.66592      423.7     35.9     36.5     5.7
   28   0   4   3  17.408  34.816  2.57471       34.3      2.9      3.0     5.7
   29   1   3   5  17.478  34.957  2.56464      418.8     35.5     36.1     5.7
   30   1   1   9  17.524  35.047  2.55824      974.5     82.6     83.9     5.7
   31   1   3   6  18.284  36.568  2.45523      126.6     10.7     10.9     5.7
   32   2   0   0  18.422  36.844  2.4375       215.1     18.2     18.5     5.7
   33   0   4   5  18.574  37.147  2.41827      189.2     16.0     16.3     5.7
   34   1   1  10  18.894  37.788  2.37877      201.3     17.1     17.3     5.7
   35   2   1   1  18.98   37.961  2.3683        28.7      2.4      2.5     5.7
   36   1   2   9  19.017  38.035  2.36388      279.1     23.7     24.0     5.7
   37   1   4   0  19.162  38.325  2.34666      179.4     15.2     15.4     5.7
   38   2   1   4  20.001  40.003  2.25201       67.6      5.7      5.8     5.7
   39   1   3   8  20.21   40.421  2.22968      108.4      9.2      9.3     5.7
   40   2   1   5  20.593  41.187  2.18995       35.2      3.0      3.0     5.7
   41   0   4   8  21.185  42.37   2.13148       61.3      5.2      5.2     5.7
   42   1   3   9  21.308  42.617  2.11973       79.0      6.7      6.8     5.7
   43   2   2   4  21.347  42.695  2.11602       21.3      1.8      1.8     5.7
   44   0   0  14  22.5    45.0    2.01286       27.7      2.3      2.4     5.7
   45   2   2   6  22.582  45.163  2.00594       25.8      2.2      2.2     5.7
   46   1   5   0  23.13   46.26   1.9609        23.3      2.0      2.0     5.7
   47   1   5   1  23.189  46.379  1.95617       25.1      2.1      2.1     5.7
   48   1   1  13  23.296  46.593  1.94767       48.0      4.1      4.1     5.7
   49   1   5   3  23.659  47.317  1.91952       15.9      1.3      1.3     5.7
   50   1   5   4  24.064  48.128  1.88908       34.3      2.9      2.9     5.7
   51   1   5   5  24.577  49.154  1.852         41.0      3.5      3.5     5.7
   52   2   0  10  24.698  49.395  1.84353       33.5      2.8      2.8     5.7
   53   1   1  14  24.848  49.697  1.83305       65.4      5.5      5.5     5.7
   54   1   3  12  25.038  50.077  1.82002       12.2      1.0      1.0     5.7
   55   2   2   9  25.184  50.369  1.81015     1179.9    100.0    100.0     5.8
   56   2   4   0  25.301  50.601  1.80238      453.1     38.4     38.4     5.8
   57   2   4   3  25.796  51.591  1.77009       39.4      3.3      3.3     5.8
   58   1   2  14  25.995  51.991  1.75744       22.6      1.9      1.9     5.8
   59   1   3  13  26.407  52.814  1.73195       99.2      8.4      8.4     5.8
   60   0   6   4  26.436  52.873  1.73017      171.3     14.5     14.5     5.8
   61   2   4   5  26.66   53.319  1.71674      161.2     13.7     13.6     5.8
   62   1   5   8  26.717  53.434  1.71331       79.8      6.8      6.7     5.8
   63   2   3   9  27.059  54.119  1.69324       14.0      1.2      1.2     5.8
   64   0   4  13  27.208  54.416  1.68471       90.5      7.7      7.6     5.8
   65   0   6   6  27.496  54.991  1.66842       41.3      3.5      3.5     5.8
   66   1   5   9  27.613  55.226  1.66189      173.8     14.7     14.6     5.8
   67   1   3  14  27.832  55.663  1.64986       98.7      8.4      8.3     5.8
   68   1   5  10  28.592  57.183  1.60956       41.6      3.5      3.5     5.8
   69   3   1   0  28.649  57.298  1.60661       52.3      4.4      4.4     5.8
   70   2   4   8  28.69   57.379  1.60454       88.3      7.5      7.4     5.8
   71   0   2  17  29.107  58.214  1.5835        61.5      5.2      5.2     5.8
   72   1   3  15  29.31   58.62   1.57351       33.7      2.9      2.8     5.8
   73   2   5   4  29.412  58.823  1.56854       14.1      1.2      1.2     5.8
   74   0   0  18  29.473  58.946  1.56556      347.6     29.5     29.1     5.8
   75   1   1  17  29.739  59.479  1.55281       50.6      4.3      4.2     5.8
   76   0   6   9  29.786  59.572  1.5506       425.9     36.1     35.7     5.8
   77   3   1   5  29.904  59.807  1.54506       35.7      3.0      3.0     5.8
   78   0   4  15  30.059  60.118  1.53782       28.0      2.4      2.3     5.8
   79   3   1   6  30.446  60.891  1.52013       13.6      1.1      1.1     5.8
   80   3   2   4  30.483  60.967  1.51842       12.2      1.0      1.0     5.8
   81   3   3   0  31.387  62.775  1.47897       55.0      4.7      4.6     5.9
   82   3   3   1  31.436  62.871  1.47693       49.7      4.2      4.1     5.9
   83   3   1   8  31.8    63.6    1.46175       56.7      4.8      4.7     5.9
   84   1   7   0  31.851  63.702  1.45967      145.8     12.4     12.1     5.9
   85   1   7   1  31.898  63.797  1.45772       84.2      7.1      7.0     5.9
   86   3   3   4  32.153  64.305  1.44742       33.9      2.9      2.8     5.9
   87   1   3  17  32.422  64.844  1.43668       77.4      6.6      6.4     5.9
   88   3   1   9  32.607  65.214  1.42942      135.5     11.5     11.2     5.9
   89   2   6   4  33.09   66.18   1.41088       46.8      4.0      3.9     5.9
   90   3   1  10  33.497  66.994  1.39571       12.7      1.1      1.0     5.9
   91   3   2   9  33.579  67.159  1.39269      103.0      8.7      8.5     5.9
   92   3   4   0  33.676  67.353  1.38914       37.2      3.2      3.1     5.9
   93   2   4  13  33.766  67.532  1.3859        24.8      2.1      2.0     5.9
   94   2   6   6  34.02   68.039  1.37679       13.5      1.1      1.1     5.9
   95   1   3  18  34.056  68.113  1.37548       96.3      8.2      8.0     5.9
   96   3   3   8  34.393  68.786  1.36365       12.5      1.1      1.0     5.9
   97   1   5  15  34.598  69.197  1.35656       17.7      1.5      1.5     5.9
   98   0   4  18  34.748  69.496  1.35145       33.5      2.8      2.8     5.9
   99   3   4   5  34.827  69.653  1.34877       20.2      1.7      1.7     5.9

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)