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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ORLANDITE

1, DF

Pb(3)Cl(4)[SeO(3)].H(2)O


Triclinic  P 1(-)  Z = 2

R =0.047          NR =1311

24 .11 .1904

Ref.Str.:

         F. Demartin, C.M. Gramaccioli, T. Pilati (2003)

         * Canad. Mineral., 41, 1147-1153

Reserv:

         There are U(ij) in the article. The mineral from mine of

         Baccu Locci, near Villaputzu, Sardinia, Italy.  D.T.N.

                   Initial data from BDM-file 

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

             a =   8.136    alpha =   62.58
             b =   8.43     beta  =   71.84
             c =   9.233    gamma =   75.13

    Unit cell volume (cub. angs.) =   529.29

    Molar volume ( cub.cm/mol.) =   159.41

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

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

   1 0.5689  0.6062  0.7553   0.0    Pb    = 0.75, Pb    = 0.0 
   2 0.5689  0.1048  0.7543   0.0    Pb    = 0.25, Pb    = 0.0 
   3 0.4904  0.8685  0.386    0.0    Se    = 0.38, Se    = 0.0 
   4 0.4926  0.7532  0.385    0.0    Se    = 0.38, Se    = 0.0 
   5 0.5042  0.6413  0.6178   0.0    Se    = 0.12, Se    = 0.0 
   6 0.5128  0.7443  0.6167   0.0    Se    = 0.12, Se    = 0.0 
   7 0.1138  0.9914  0.7174   0.0    Pb    = 1.00
   8 0.1208  0.482   0.7168   0.0    Pb    = 1.00
   9 0.1924  0.0956  0.9616   0.0    Cl    = 1.00
  10 0.1923  0.6001  0.9541   0.0    Cl    = 1.00
  11 0.8628  0.3319  0.6546   0.0    Cl    = 1.00
  12 0.1324  0.1694  0.3466   0.0    Cl    = 1.00
  13 0.4992  0.7555  0.9967   0.0    H(2)O = 1.00
  14 0.671   0.7415  0.4332   0.0    O     = 1.00
  15 0.5742  0.0638  0.3343   0.0    O     = 0.5 , O     = 0.0 
  16 0.5657  0.5653  0.3347   0.0    O     = 0.5 , O     = 0.0 
  17 0.3685  0.8144  0.5799   0.0    O     = 0.5 , O     = 0.0 
  18 0.3661  0.6707  0.5796   0.0    O     = 0.5 , O     = 0.0 


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.5689     0.6062     0.7553
     2       2     0.5689     0.1048     0.7543
     3       3     0.4904     0.8685     0.386 
     4       4     0.4926     0.7532     0.385 
     5       5     0.5042     0.6413     0.6178
     6       6     0.5128     0.7443     0.6167
     7       7     0.1138     0.9914     0.7174
     8       8     0.1208     0.482      0.7168
     9       9     0.1924     0.0956     0.9616
    10      10     0.1923     0.6001     0.9541
    11      11     0.8628     0.3319     0.6546
    12      12     0.1324     0.1694     0.3466
    13      13     0.4992     0.7555     0.9967
    14      14     0.671      0.7415     0.4332
    15      15     0.5742     0.0638     0.3343
    16      16     0.5657     0.5653     0.3347
    17      17     0.3685     0.8144     0.5799
    18      18     0.3661     0.6707     0.5796
    19       1     0.4311     0.3938     0.2447
    20       2     0.4311     0.8952     0.2457
    21       3     0.5096     0.1315     0.614 
    22       4     0.5074     0.2468     0.615 
    23       5     0.4958     0.3587     0.3822
    24       6     0.4872     0.2557     0.3833
    25       7     0.8862     0.0086     0.2826
    26       8     0.8792     0.518      0.2832
    27       9     0.8076     0.9044     0.0384
    28      10     0.8077     0.3999     0.0459
    29      11     0.1372     0.6681     0.3454
    30      12     0.8676     0.8306     0.6534
    31      13     0.5008     0.2445     0.0033
    32      14     0.329      0.2585     0.5668
    33      15     0.4258     0.9362     0.6657
    34      16     0.4343     0.4347     0.6653
    35      17     0.6315     0.1856     0.4201
    36      18     0.6339     0.3293     0.4204


X-ray density (g/cm cub.)   =      5.7 

MU (1/cm) =    1522.188    Mass attenuation coefficient (cm**2/g) =    267.151

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

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

    1   Pb   ,Pb             3.684       11
                                                 3.0411      10
                                                 3.1122      11
                                                 2.8815      13
                                                 2.5802      14
                                                 2.4333      17
                                                 2.4587      18
                                                 3.349       10
                                                 3.1088      12
                                                 2.9143      13
                                                 2.5685      15
                                                 2.5429      16
    2   Pb   ,Pb             3.684       11
                                                 3.0632       9
                                                 3.0959      11
                                                 2.828       13
                                                 3.304        9
                                                 3.1314      12
                                                 2.8886      13
                                                 2.6885      14
                                                 2.561       15
                                                 2.5499      16
                                                 2.74        17
                                                 2.7367      18
    3   Se   ,Se             3.0          6
                                                 1.6301      14
                                                 1.7472      15
                                                 2.695       16
                                                 1.6644      17
                                                 1.998       18
                                                 2.762       15
    4   Se   ,Se             3.0          6
                                                 1.6135      14
                                                 2.6618      15
                                                 1.7608      16
                                                 1.9947      17
                                                 1.6838      18
                                                 2.7605      16
    5   Se   ,Se             3.0          6
                                                 1.8113      14
                                                 2.8383      16
                                                 1.5538      17
                                                 1.2132      18
                                                 2.6088      15
                                                 1.7884      16
    6   Se   ,Se             3.0          6
                                                 1.786       14
                                                 2.7772      15
                                                 1.2452      17
                                                 1.6606      18
                                                 1.7915      15
                                                 2.6494      16
    7    Pb                  3.684       10
                                                 3.0456       9
                                                 3.0355      10
                                                 2.9904      11
                                                 3.0096      12
                                                 2.5788      17
                                                 3.4399      18
                                                 3.1403       9
                                                 3.0113      12
                                                 2.7733      14
                                                 2.394       15
    8    Pb                  3.684       10
                                                 3.0206       9
                                                 3.0382      10
                                                 3.0201      11
                                                 3.3999      17
                                                 2.5131      18
                                                 3.2162      10
                                                 3.0175      11
                                                 3.0467      12
                                                 2.7641      14
                                                 2.4057      16
    9    Cl                  4.344       12
                                                 4.2213      10
                                                 4.2096      10
                                                 3.9987      11
                                                 3.7497      12
                                                 3.2451      13
                                                 3.6133       9
                                                 3.6307      10
                                                 3.718       11
                                                 3.2686      13
                                                 3.1711      14
                                                 3.4225      15
                                                 3.4435      16
   10    Cl                  4.344       13
                                                 4.2096       9
                                                 4.2213       9
                                                 3.7738      12
                                                 3.2972      13
                                                 3.1223      17
                                                 3.1303      18
                                                 3.6307       9
                                                 3.6191      10
                                                 3.7879      11
                                                 3.9283      12
                                                 3.3298      13
                                                 3.3746      15
                                                 3.4167      16
   11    Cl                  4.344       14
                                                 3.9987       9
                                                 3.5962      12
                                                 3.3554      14
                                                 3.8852      16
                                                 3.718        9
                                                 3.7879      10
                                                 3.6041      11
                                                 4.2091      12
                                                 4.2212      12
                                                 3.5498      13
                                                 3.5732      14
                                                 3.3509      16
                                                 3.9926      17
                                                 3.2741      18
   12    Cl                  4.344       15
                                                 3.7497       9
                                                 3.7738      10
                                                 3.5962      11
                                                 3.4528      15
                                                 3.3132      17
                                                 4.0043      18
                                                 3.9283      10
                                                 4.2091      11
                                                 4.2212      11
                                                 3.5673      12
                                                 3.5546      13
                                                 3.3625      14
                                                 3.858       15
                                                 3.894       17
                                                 3.8792      18
   13    H(2)O               3.972        8
                                                 3.2451       9
                                                 3.2972      10
                                                 2.9328      16
                                                 3.2686       9
                                                 3.3298      10
                                                 3.5498      11
                                                 3.5546      12
                                                 2.8983      15
   14    O                   3.804       12
                                                 3.3554      11
                                                 2.4292      15
                                                 2.48        16
                                                 2.4863      17
                                                 2.5027      18
                                                 3.1711       9
                                                 3.5732      11
                                                 3.3625      12
                                                 3.1901      15
                                                 3.1415      16
                                                 3.6226      17
                                                 3.6219      18
   15   O    ,O              3.804       11
                                                 3.4528      12
                                                 2.4292      14
                                                 2.7226      17
                                                 3.5432      18
                                                 3.4225       9
                                                 3.3746      10
                                                 2.8983      13
                                                 3.1901      14
                                                 2.7036      15
                                                 1.7675      17
                                                 2.8835      18
   16   O    ,O              3.804       11
                                                 2.9328      13
                                                 2.48        14
                                                 3.5347      17
                                                 2.713       18
                                                 3.4435       9
                                                 3.4167      10
                                                 3.3509      11
                                                 3.1415      14
                                                 2.6734      16
                                                 2.8658      17
                                                 1.7746      18
   17   O    ,O              3.804       10
                                                 3.1223      10
                                                 3.3132      12
                                                 2.4863      14
                                                 2.7226      15
                                                 3.5347      16
                                                 1.2178      18
                                                 3.6226      14
                                                 1.7675      15
                                                 2.8658      16
                                                 3.71        17
   18   O    ,O              3.804       10
                                                 3.1303      10
                                                 2.5027      14
                                                 3.5432      15
                                                 2.713       16
                                                 1.2178      17
                                                 3.2741      11
                                                 3.6219      14
                                                 2.8835      15
                                                 1.7746      16
                                                 3.7245      18

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

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

    1   0   0   1  6.432  12.864   0.063  156.41    2      104.1     1210.1
    2   1   0   0  6.705  13.41    0.065  143.75    2       45.1      209.0
    3   0   1   0  6.928  13.856   0.067  134.5     2       50.6      246.3
    4   0   1   1  7.244  14.489   0.07   122.82    2       31.8       88.6
    5   1   1   1  8.101  16.201   0.079   97.78    2       66.2      305.6
    6   1   0   1  8.188  16.375   0.08    95.67    2      132.9     1206.7
    7   1   1   0  8.988  17.975   0.087   79.02    2       22.8       29.2
    8  -1   1   0 10.298  20.596   0.1     59.67    2       77.2      253.6
    9  -1   0   1 10.318  20.636   0.1     59.43    2      129.5      712.1
   10   0  -1   1 11.285  22.571   0.109   49.33    2       15.5        8.4
   11  -1   1   1 11.421  22.842   0.111   48.12    2       18.9       12.3
   12   1   1   2 11.596  23.193   0.112   46.61    2        9.2        2.8
   13   0   1   2 11.876  23.752   0.115   44.34    2       26.6       22.3
   14   0   2   1 12.703  25.405   0.123   38.5     2       86.1      203.6
   15   1   2   1 12.727  25.453   0.123   38.35    2       87.3      208.6
   16   1  -1   1 12.895  25.791   0.125   37.3     2        7.7        1.6
   17   0   0   2 12.947  25.894   0.125   36.98    2      368.0     3576.3
   18   2   1   1 13.062  26.123   0.126   36.3     2       68.7      122.3
   19   1   0   2 13.185  26.371   0.128   35.59    2      126.0      403.1
   20  -1  -1   1 13.444  26.887   0.13    34.15    2       40.4       39.8
   21   2   0   0 13.504  27.008   0.131   33.83    2      150.2      544.8
   22   2   0   1 13.598  27.196   0.131   33.34    2      287.0     1960.6
   23   1   2   2 13.921  27.843   0.134   31.72    2      264.3     1582.0
   24   0   2   0 13.96   27.92    0.135   31.53    2      261.0     1533.2
   25   2   1   0 14.362  28.723   0.139   29.68    2        9.8        2.0
   26   0   2   2 14.608  29.216   0.141   28.62    2      233.9     1118.2
   27   1   2   0 14.686  29.373   0.142   28.3     2      237.4     1138.3
   28   2   1   2 14.855  29.71    0.143   27.62    2       26.0       13.4
   29  -1   1   2 15.516  31.032   0.15    25.15    2       59.4       63.3
   30  -1   2   1 15.942  31.884   0.154   23.73    2      401.8     2735.0
   31  -1   0   2 15.962  31.925   0.154   23.66    2       47.2       37.7
   32   2   2   1 16.0    31.999   0.154   23.54    2      399.1     2677.1
   33  -2   1   0 16.071  32.142   0.155   23.32    2       35.8       21.4
   34  -2   0   1 16.311  32.622   0.157   22.58    2      411.0     2723.4
   35  -1   2   0 16.365  32.73    0.157   22.42    2      199.8      639.0
   36   2   2   2 16.369  32.738   0.158   22.41    2      201.2      647.7
   37   2   0   2 16.548  33.097   0.159   21.88    2      163.0      415.2
   38   1   1   3 17.059  34.118   0.164   20.49    2       96.1      135.1
   39   0  -1   2 17.17   34.339   0.165   20.2     2       91.0      119.4
   40   2  -1   1 17.315  34.63    0.166   19.83    2       44.4       27.9
   41  -2   1   1 17.436  34.872   0.167   19.53    2        8.6        1.0
   42   1   2   3 17.69   35.38    0.17    18.92    2       83.5       94.2
   43   1  -1   2 17.731  35.463   0.17    18.83    2       97.5      127.9
   44   0  -2   1 17.77   35.54    0.171   18.74    2       81.2       88.2
   45   0   1   3 17.844  35.689   0.171   18.57    2       69.0       63.0
   46  -1   2   2 18.107  36.214   0.174   17.98    2      137.1      241.3
   47  -2  -1   1 18.153  36.307   0.174   17.88    2       52.1       34.6
   48   2   2   0 18.206  36.413   0.175   17.77    2      134.5      229.3
   49   0   2   3 18.809  37.619   0.18    16.54    2       76.4       68.8
   50   1   3   2 18.857  37.713   0.181   16.45    2       57.3       38.5
   51  -1  -2   1 18.919  37.837   0.181   16.33    2       74.4       64.5
   52   2   1   3 18.952  37.903   0.182   16.27    2       88.0       90.0
   53   1   3   1 19.029  38.058   0.182   16.12    2       53.7       33.2
   54   2   2   3 19.184  38.368   0.184   15.83    2      360.8     1471.3
   55   1  -2   1 19.226  38.451   0.184   15.76    2      364.1     1491.6
   56  -1  -1   2 19.259  38.519   0.184   15.7     2       61.4       42.2
   57   1   0   3 19.267  38.533   0.184   15.68    2       72.1       58.1
   58   3   1   1 19.329  38.659   0.185   15.57    2       49.5       27.2
   59   0   3   1 19.361  38.722   0.185   15.51    2       39.4       17.2
   60   0   0   3 19.638  39.275   0.188   15.03    2      283.0      859.6
   61   0   3   2 19.729  39.459   0.189   14.88    2       42.5       19.2
   62   3   0   1 20.05   40.1     0.192   14.36    2       88.7       80.5
   63   3   1   2 20.118  40.237   0.192   14.25    2       51.3       26.7
   64   2   3   2 20.463  40.927   0.195   13.72    2       64.0       40.1
   65   3   0   0 20.504  41.007   0.196   13.66    2      334.1     1088.5
   66   2  -1   2 20.759  41.518   0.198   13.29    2       65.2       40.3
   67   3   1   0 20.783  41.566   0.198   13.25    2       19.3        3.5
   68   1   3   3 20.939  41.878   0.2     13.03    2       46.3       19.9
   69  -2   2   0 20.949  41.898   0.2     13.02    2      146.7      200.0
   70  -2   1   2 20.966  41.932   0.2     12.99    2       35.5       11.7
   71   3   2   2 20.983  41.967   0.2     12.97    2      151.1      211.5
   72  -2   0   2 20.991  41.982   0.2     12.96    2      108.1      108.0
   73  -1   1   3 21.05   42.099   0.201   12.88    2       48.1       21.2
   74  -2   2   1 21.116  42.232   0.201   12.79    2      223.7      457.0
   75   2   3   1 21.132  42.264   0.202   12.77    2        4.2        0.2
   76   3   2   1 21.192  42.384   0.202   12.69    2      227.6      469.0
   77   0   3   0 21.215  42.43    0.202   12.65    2       28.5        7.4
   78   2   0   3 21.31   42.621   0.203   12.53    2      306.5      840.4
   79   1   3   0 21.41   42.819   0.204   12.4     2       43.0       16.3
   80   3   0   2 21.764  43.529   0.207   11.95    2       72.3       44.6
   81   2   3   3 21.938  43.876   0.209   11.74    2        5.1        0.2
   82  -1   3   1 22.036  44.072   0.21    11.62    2       85.8       61.1
   83  -1   2   3 22.206  44.413   0.211   11.42    2      429.0     1500.8
   84   0   3   3 22.228  44.457   0.211   11.39    2       23.6        4.5
   85  -1   0   3 22.324  44.647   0.212   11.29    2      177.7      254.5
   86  -2  -2   1 22.331  44.662   0.212   11.28    2      429.0     1482.0
   87  -3   1   0 22.671  45.343   0.215   10.9     2       56.9       25.2
   88  -1   3   2 22.844  45.689   0.217   10.71    2       33.0        8.3
   89   3   2   3 22.857  45.715   0.217   10.7     2      216.6      358.4
   90   2  -2   1 22.865  45.73    0.217   10.69    2      214.3      350.6
   91   1   2   4 22.937  45.875   0.218   10.61    2      351.8      937.7
   92   3   1   3 22.959  45.918   0.218   10.59    2       79.5       47.7
   93  -3   0   1 23.021  46.042   0.219   10.53    2       34.5        8.9
   94   0  -2   2 23.041  46.082   0.219   10.51    2      348.7      911.8
   95   3  -1   1 23.155  46.309   0.22    10.39    2       80.6       48.2
   96  -1   3   0 23.257  46.514   0.221   10.29    2       26.7        5.2
   97   1   1   4 23.327  46.655   0.221   10.22    2       32.7        7.8
   98  -2   2   2 23.33   46.66    0.221   10.21    2       28.6        6.0
   99  -2  -1   2 23.399  46.798   0.222   10.15    2       23.3        3.9
  100   3   2   0 23.439  46.878   0.222   10.11    2       31.6        7.2
  101   1  -1   3 23.64   47.281   0.224    9.91    2       28.6        5.8
  102   0  -1   3 23.663  47.326   0.224    9.89    2       39.8       11.2
  103   2   2   4 23.705  47.41    0.225    9.85    2      144.1      146.1
  104   1  -2   2 23.779  47.557   0.225    9.78    2      143.8      144.4
  105   2   3   0 23.797  47.595   0.226    9.77    2       32.1        7.2
  106   3   3   2 24.14   48.28    0.229    9.45    2       74.2       37.1
  107  -3  -1   1 24.148  48.295   0.229    9.45    2       55.6       20.8
  108  -3   1   1 24.168  48.336   0.229    9.43    2       57.5       22.3
  109   0   2   4 24.305  48.609   0.23     9.31    2      202.2      271.7
  110   2   1   4 24.375  48.749   0.231    9.25    2        2.3        0.0
  111   0   1   4 24.392  48.784   0.231    9.23    2       53.4       18.8
  112  -1  -2   2 24.431  48.863   0.231    9.2     2      206.6      280.4
  113   1   3   4 24.809  49.619   0.235    8.88    2       68.3       29.6
  114   0  -3   1 24.887  49.773   0.235    8.82    2       50.4       16.0
  115   3   3   3 25.008  50.015   0.236    8.72    2       20.9        2.7
  116   1   4   2 25.114  50.229   0.237    8.64    2      520.7     1672.4
  117   3   3   1 25.171  50.342   0.238    8.6     2       21.2        2.8
  118   2   3   4 25.255  50.51    0.238    8.53    2       68.7       28.7
  119   3   0   3 25.293  50.585   0.239    8.5     2      262.2      417.2
  120  -1  -3   1 25.497  50.993   0.241    8.35    2       74.8       33.4
  121   3  -1   2 25.531  51.062   0.241    8.32    2      101.6       61.3
  122  -1   3   3 25.532  51.064   0.241    8.32    2       53.6       17.1
  123   2  -1   3 25.679  51.358   0.242    8.21    2       24.4        3.5
  124  -1  -1   3 25.743  51.485   0.243    8.17    2       73.8       31.8
  125   1   0   4 25.902  51.804   0.244    8.05    2      186.6      200.3
  126  -2   1   3 25.943  51.885   0.245    8.02    2       27.5        4.3
  127   1   4   3 26.002  52.003   0.245    7.98    2       41.3        9.7
  128   1   4   1 26.073  52.147   0.246    7.93    2       39.5        8.8
  129   0   4   2 26.09   52.18    0.246    7.92    2       85.7       41.5
  130   2   4   2 26.142  52.284   0.246    7.89    2       91.9       47.5
  131   4   1   1 26.227  52.455   0.247    7.83    2        6.7        0.3
  132   1  -3   1 26.289  52.577   0.248    7.79    2       84.9       40.1
  133   0   3   4 26.376  52.751   0.248    7.73    2       75.0       31.0
  134   4   1   2 26.433  52.866   0.249    7.69    2       89.6       44.1
  135   3   2   4 26.467  52.934   0.249    7.67    2      203.4      226.3
  136  -2   3   1 26.486  52.971   0.249    7.65    2       69.9       26.7
  137   2  -2   2 26.51   53.019   0.25     7.64    2      199.7      217.5
  138   2   4   3 26.585  53.17    0.25     7.59    2       60.8       20.1
  139   0   4   1 26.605  53.21    0.25     7.58    2       69.5       26.1
  140   0   0   4 26.622  53.243   0.25     7.57    2      247.3      330.2
  141  -2   0   3 26.77   53.54    0.252    7.47    2      338.2      609.9
  142  -3   2   0 26.818  53.637   0.252    7.44    2      299.9      477.7
  143   4   2   2 26.872  53.744   0.253    7.41    2      299.2      473.3
  144   4   0   1 27.068  54.135   0.254    7.29    2      243.8      309.1
  145   2   0   4 27.142  54.284   0.255    7.24    2      232.0      278.3
  146  -2   3   0 27.144  54.287   0.255    7.24    2        0.5        0.0
  147  -3   0   2 27.154  54.308   0.255    7.23    2      237.1      290.2
  148  -2   2   3 27.204  54.407   0.256    7.2     2      141.5      102.9
  149  -3  -2   1 27.336  54.672   0.257    7.12    2      146.6      109.2
  150   3   1   4 27.353  54.705   0.257    7.11    2       19.7        2.0
  151   0   4   3 27.371  54.741   0.257    7.1     2      150.4      114.7
  152  -3   2   1 27.373  54.746   0.257    7.1     2      203.0      208.9
  153  -1   1   4 27.384  54.768   0.257    7.1     2       93.8       44.6
  154  -3   1   2 27.399  54.798   0.257    7.09    2       55.3       15.5
  155   4   2   1 27.461  54.921   0.258    7.05    2      203.8      209.1
  156   2   4   1 27.49   54.98    0.258    7.03    2      143.0      102.6
  157  -1   2   4 27.568  55.137   0.259    6.99    2      139.2       96.7
  158  -2   3   2 27.607  55.215   0.259    6.97    2        8.2        0.3
  159   3   3   4 27.643  55.286   0.259    6.94    2       69.2       23.8
  160  -2  -2   2 27.709  55.418   0.26     6.91    2      138.4       94.5
  161   4   1   0 27.803  55.605   0.261    6.85    2       46.6       10.6
  162   4   0   0 27.841  55.683   0.261    6.83    2      265.9      345.0
  163   3   3   0 27.947  55.895   0.262    6.77    2       60.0       17.4
  164  -2  -3   1 28.024  56.049   0.263    6.73    2       29.9        4.3
  165   3  -2   1 28.027  56.054   0.263    6.73    2      184.6      163.7
  166   4   2   3 28.045  56.09    0.263    6.72    2      185.3      164.7
  167   4   0   2 28.049  56.098   0.263    6.72    2      226.8      246.7
  168   4   1   3 28.392  56.785   0.266    6.54    2       56.7       15.0
  169   1   4   4 28.614  57.227   0.268    6.42    2      329.2      496.9
  170   1   4   0 28.748  57.496   0.269    6.35    2      331.9      499.8
  171   2   4   4 28.763  57.525   0.269    6.35    2       95.3       41.1
  172   0   4   0 28.848  57.696   0.27     6.3     2       92.5       38.5
  173  -3  -1   2 28.923  57.846   0.27     6.27    2        9.6        0.4
  174  -1   4   2 28.926  57.853   0.27     6.27    2       88.6       35.1
  175  -1   4   1 29.01   58.021   0.271    6.23    2      284.7      360.1
  176   3   4   2 29.023  58.046   0.271    6.22    2       90.2       36.1
  177   3   4   3 29.04   58.08    0.271    6.21    2      289.2      370.8
  178   1   2   5 29.101  58.201   0.272    6.18    2      169.5      126.9
  179  -1   0   4 29.201  58.402   0.273    6.13    2       90.4       35.8
  180   0  -2   3 29.222  58.444   0.273    6.12    2      166.7      121.4
  181   4   3   2 29.304  58.607   0.274    6.09    2       43.8        8.3
  182   2   2   5 29.359  58.718   0.274    6.06    2       86.8       32.6
  183   1  -2   3 29.456  58.911   0.275    6.02    2       90.5       35.2
  184   3  -1   3 29.468  58.937   0.275    6.01    2       38.5        6.3
  185   2  -3   1 29.5    59.0     0.275    6.0     2       55.3       13.1
  186  -2  -1   3 29.565  59.131   0.276    5.97    2       75.5       24.3
  187  -3   2   2 29.625  59.25    0.276    5.94    2      333.3      470.9
  188   4   3   3 29.675  59.35    0.277    5.92    2       49.8       10.5
  189  -1   3   4 29.73   59.459   0.277    5.89    2       11.5        0.6
  190   4   2   0 29.741  59.482   0.277    5.89    2      334.0      468.8
  191  -4   1   0 29.852  59.704   0.278    5.84    2        6.4        0.2
  192   4  -1   1 29.862  59.724   0.278    5.83    2       58.8       14.4
  193   0  -3   2 29.89   59.779   0.279    5.82    2       27.1        3.1
  194   1   3   5 29.968  59.936   0.279    5.79    2       57.0       13.4
  195   2   3   5 29.972  59.945   0.279    5.79    2        1.5        0.0
  196   1   1   5 30.175  60.35    0.281    5.7     2       64.8       17.1
  197   3   0   4 30.177  60.354   0.281    5.7     2       44.2        7.9
  198   1  -1   4 30.26   60.52    0.282    5.66    2       70.1       19.8
  199  -4   0   1 30.281  60.562   0.282    5.65    2      111.2       49.9
  200   0   4   4 30.292  60.583   0.282    5.65    2       25.5        2.6
  201  -2   3   3 30.376  60.751   0.283    5.62    2       80.6       26.1
  202   2   4   0 30.468  60.936   0.283    5.58    2       32.4        4.2
  203  -1   4   3 30.514  61.028   0.284    5.56    2      328.1      427.1
  204   4   3   1 30.598  61.196   0.285    5.52    2       36.6        5.3
  205   0   2   5 30.654  61.309   0.285    5.5     2       83.0       27.0
  206   0  -1   4 30.666  61.332   0.285    5.5     2       53.7       11.3
  207   3   4   1 30.672  61.343   0.285    5.5     2      332.8      434.5
  208   4   0   3 30.674  61.348   0.285    5.49    2      311.0      379.3
  209   2   1   5 30.675  61.35    0.285    5.49    2       75.8       22.5
  210   3   4   4 30.722  61.444   0.286    5.48    2      160.3      100.5
  211   1  -3   2 30.755  61.51    0.286    5.46    2       12.7        0.6
  212  -1   4   0 30.758  61.515   0.286    5.46    2      157.2       96.4
  213  -1  -2   3 30.795  61.59    0.286    5.45    2       82.7       26.6
  214  -1  -3   2 30.816  61.632   0.286    5.44    2       69.7       18.9
  215   4   2   4 30.847  61.693   0.287    5.43    2      187.8      136.6
  216   3  -2   2 30.862  61.724   0.287    5.42    2      188.6      137.6
  217  -4  -1   1 30.976  61.953   0.288    5.38    2       15.6        0.9
  218   3   2   5 31.402  62.804   0.291    5.22    2      119.7       53.4
  219   0   1   5 31.454  62.908   0.292    5.2     2       38.4        5.5
  220   2  -2   3 31.472  62.944   0.292    5.19    2      118.6       52.1
  221  -4   1   1 31.482  62.963   0.292    5.19    2       23.1        2.0
  222   4  -1   2 31.51   63.021   0.292    5.18    2       43.7        7.1
  223   2  -1   4 31.629  63.258   0.293    5.14    2       61.0       13.7
  224   4   3   4 31.677  63.353   0.294    5.12    2       53.1       10.3
  225   0   3   5 31.738  63.476   0.294    5.1     2       58.2       12.3
  226   3   3   5 31.751  63.501   0.294    5.09    2       15.1        0.8
  227   4   1   4 31.894  63.788   0.295    5.04    2       53.8       10.4
  228  -2   1   4 31.937  63.874   0.296    5.03    2       62.2       13.9
  229  -3   1   3 32.013  64.026   0.296    5.0     2       38.2        5.2
  230  -3  -3   1 32.17   64.34    0.298    4.95    2        2.1        0.0
  231  -3   3   1 32.221  64.442   0.298    4.93    2        4.0        0.1
  232   1   5   2 32.261  64.521   0.298    4.92    2       45.4        7.3
  233   1   5   3 32.315  64.63    0.299    4.9     2        7.1        0.2
  234  -2   2   4 32.345  64.69    0.299    4.89    2      135.7       64.3
  235  -3   3   0 32.433  64.866   0.3      4.86    2       80.1       22.3
  236   2   4   5 32.449  64.898   0.3      4.86    2       76.8       20.4
  237  -3  -2   2 32.495  64.99    0.3      4.84    2      133.9       62.0
  238  -3   0   3 32.502  65.005   0.3      4.84    2      113.9       44.8
  239   2   5   3 32.588  65.176   0.301    4.81    2       90.1       27.9
  240   0  -4   1 32.591  65.183   0.301    4.81    2       69.1       16.4
  241   1   4   5 32.684  65.367   0.302    4.78    2      212.4      154.1
  242  -1  -1   4 32.809  65.617   0.303    4.74    2       34.1        3.9
  243  -1  -4   1 32.87   65.74    0.303    4.72    2      212.1      151.7
  244   2   5   2 32.905  65.811   0.304    4.71    2        0.7        0.0
  245   3   1   5 32.907  65.815   0.304    4.71    2       59.5       11.9
  246  -2   4   1 33.029  66.059   0.305    4.68    2       60.3       12.2
  247   1   0   5 33.077  66.155   0.305    4.66    2      121.8       49.4
  248   4   4   3 33.101  66.203   0.305    4.65    2       64.9       14.0
  249  -2   4   2 33.32   66.641   0.307    4.59    2      255.8      214.4
  250   2  -3   2 33.331  66.662   0.307    4.59    2        1.3        0.0
  251   0   5   2 33.334  66.667   0.307    4.59    2       98.6       31.8
  252  -3   2   3 33.361  66.722   0.307    4.58    2       44.4        6.4
  253  -2   0   4 33.368  66.736   0.307    4.58    2      125.5       51.4
  254   4   3   0 33.444  66.888   0.308    4.55    2       47.3        7.3
  255  -2  -3   2 33.448  66.896   0.308    4.55    2       59.9       11.7
  256   4   4   2 33.454  66.908   0.308    4.55    2      250.5      203.8
  257  -4  -2   1 33.5    67.001   0.309    4.54    2       44.9        6.5
  258   5   1   2 33.539  67.079   0.309    4.53    2       89.5       25.9
  259  -3   3   2 33.587  67.175   0.309    4.51    2       43.2        6.0
  260  -4   2   0 33.618  67.235   0.309    4.5     2      167.3       90.0
  261  -1   4   4 33.632  67.264   0.31     4.5     2       83.5       22.4
  262   5   2   2 33.687  67.373   0.31     4.48    2      171.1       93.7
  263   5   1   1 33.729  67.458   0.31     4.47    2       19.8        1.3
  264   0   5   3 33.754  67.508   0.311    4.47    2       25.8        2.1
  265   1   5   1 33.781  67.561   0.311    4.46    2       11.6        0.4
  266   2   0   5 33.788  67.575   0.311    4.46    2      298.7      283.8
  267   2   5   4 33.842  67.683   0.311    4.44    2       23.3        1.7
  268   3   4   0 33.843  67.686   0.311    4.44    2       83.9       22.3
  269  -1   2   5 33.873  67.745   0.312    4.43    2      234.2      173.6
  270   3   4   5 33.922  67.845   0.312    4.42    2      283.3      253.2
  271   1   5   4 33.94   67.88    0.312    4.42    2       24.5        1.9
  272   1  -4   1 34.017  68.035   0.313    4.39    2      282.9      251.1
  273  -2  -2   3 34.028  68.056   0.313    4.39    2      234.9      173.0
  274   0   0   5 34.064  68.128   0.313    4.38    2      130.3       53.1
  275  -4   0   2 34.173  68.347   0.314    4.35    2      309.1      296.9
  276   3  -3   1 34.208  68.417   0.314    4.34    2       21.3        1.4
  277  -2   4   0 34.299  68.598   0.315    4.32    2       69.3       14.8
  278   4   4   4 34.309  68.618   0.315    4.32    2       61.3       11.6
  279   4  -2   1 34.319  68.638   0.315    4.31    2        5.0        0.1
  280   5   2   3 34.357  68.714   0.315    4.3     2       10.5        0.3
  281  -1   1   5 34.401  68.802   0.316    4.29    2       25.2        2.0
  282  -4   2   1 34.467  68.934   0.316    4.28    2       20.1        1.2
  283   0   5   1 34.469  68.937   0.316    4.28    2       58.6       10.5
  284   3   5   3 34.552  69.103   0.317    4.25    2       66.8       13.6
  285  -2   3   4 34.557  69.115   0.317    4.25    2        8.8        0.2
  286   5   2   1 34.566  69.131   0.317    4.25    2       16.7        0.8
  287   0   4   5 34.608  69.215   0.317    4.24    2      189.2      108.4
  288  -4   1   2 34.62   69.24    0.318    4.24    2       24.5        1.8
  289   3  -1   4 34.656  69.311   0.318    4.23    2       68.7       14.3
  290   4  -1   3 34.665  69.33    0.318    4.23    2       23.0        1.6
  291   5   0   1 34.686  69.372   0.318    4.22    2       93.0       26.0
  292   4   0   4 34.726  69.452   0.318    4.21    2      205.4      126.8
  293   2   5   1 34.773  69.545   0.319    4.2     2       64.4       12.4
  294  -3  -1   3 34.79   69.579   0.319    4.2     2       77.1       17.8
  295  -2  -4   1 34.833  69.666   0.319    4.19    2      185.3      102.6
  296   5   1   3 34.898  69.796   0.32     4.17    2       58.1       10.0
  297   4   2   5 35.053  70.105   0.321    4.13    2      163.7       79.1
  298   3  -2   3 35.097  70.194   0.321    4.12    2      163.0       78.2
  299  -1   3   5 35.133  70.266   0.322    4.11    2       52.8        8.2
  300   4   3   5 35.153  70.307   0.322    4.11    2       43.3        5.5
  301  -2   4   3 35.153  70.307   0.322    4.11    2       45.7        6.1
  302   5   0   2 35.183  70.367   0.322    4.1     2      166.0       80.7
  303   3   5   2 35.22   70.44    0.322    4.09    2        9.0        0.2
  304   4   4   1 35.344  70.687   0.323    4.06    2       50.3        7.3
  305   3   5   4 35.415  70.83    0.324    4.05    2       29.1        2.4
  306   5   1   0 35.454  70.909   0.324    4.04    2       69.8       14.0
  307  -4  -1   2 35.508  71.016   0.325    4.03    2       17.5        0.9
  308   5   3   3 35.594  71.187   0.325    4.01    2       68.6       13.5
  309   5   3   2 35.614  71.229   0.326    4.0     2       13.1        0.5
  310   0   5   4 35.703  71.407   0.326    3.98    2       84.5       20.3
  311   5   0   0 35.717  71.434   0.326    3.98    2      165.0       77.4
  312   2   3   6 35.803  71.607   0.327    3.96    2       59.4       10.0
  313   2   2   6 35.924  71.847   0.328    3.94    2      171.2       82.4
  314   0  -3   3 35.951  71.901   0.328    3.93    2       33.8        3.2
  315   1  -2   4 36.04   72.08    0.329    3.91    2      171.5       82.1
  316   1   2   6 36.047  72.095   0.329    3.91    2      268.3      200.9
  317  -1   5   2 36.048  72.095   0.329    3.91    2       32.0        2.9
  318   3   0   5 36.146  72.293   0.33     3.89    2       63.3       11.1
  319   1   3   6 36.155  72.31    0.33     3.89    2       30.9        2.7
  320   0  -2   4 36.185  72.371   0.33     3.88    2      268.7      200.0
  321   1  -3   3 36.387  72.775   0.332    3.84    2       90.2       22.3
  322  -3   3   3 36.445  72.889   0.332    3.83    2        7.8        0.2
  323  -2  -1   4 36.529  73.059   0.333    3.81    2        8.5        0.2
  324   4  -2   2 36.53   73.06    0.333    3.81    2      129.8       45.9
  325   5   2   4 36.538  73.075   0.333    3.81    2      130.8       46.5
  326   2   5   5 36.589  73.177   0.333    3.8     2       82.9       18.6
  327  -1   0   5 36.683  73.365   0.334    3.78    2      315.8      269.2
  328   4   1   5 36.709  73.418   0.334    3.78    2       31.5        2.7
  329   1   5   0 36.78   73.56    0.335    3.76    2       62.8       10.6
  330  -1   5   1 36.794  73.587   0.335    3.76    2        0.3        0.0
  331  -1   5   3 36.806  73.613   0.335    3.76    2        3.6        0.0
  332  -4   2   2 36.818  73.636   0.335    3.75    2        3.7        0.0
  333   5   2   0 36.943  73.886   0.336    3.73    2        7.3        0.1
  334   4   4   5 37.005  74.009   0.336    3.72    2      204.9      111.5
  335   1   5   5 37.036  74.071   0.337    3.71    2       23.8        1.5
  336   2  -4   1 37.054  74.107   0.337    3.71    2      201.8      107.9
  337   5   3   4 37.079  74.159   0.337    3.71    2       37.0        3.6
  338   3   3   6 37.088  74.176   0.337    3.7     2       67.5       12.0
  339   0   5   0 37.093  74.186   0.337    3.7     2       66.2       11.6
  340   5   3   1 37.141  74.282   0.338    3.69    2       43.1        4.9
  341  -1  -3   3 37.148  74.297   0.338    3.69    2       43.4        5.0
  342   5   0   3 37.183  74.365   0.338    3.69    2       35.9        3.4
  343   5  -1   1 37.375  74.75    0.339    3.65    2      109.4       31.2
  344   3   5   1 37.384  74.769   0.339    3.65    2       58.1        8.8
  345   2   4   6 37.426  74.851   0.34     3.64    2      134.4       47.0
  346   3   2   6 37.431  74.862   0.34     3.64    2      301.6      236.5
  347   3  -3   2 37.442  74.884   0.34     3.64    2       81.5       17.3
  348   2  -2   4 37.525  75.05    0.34     3.62    2      298.7      230.9
  349   1  -1   5 37.594  75.189   0.341    3.61    2       27.1        1.9
  350  -3  -3   2 37.609  75.218   0.341    3.61    2       65.2       11.0
  351   0  -4   2 37.618  75.236   0.341    3.61    2      132.8       45.4
  352  -4  -3   1 37.671  75.342   0.342    3.6     2       28.6        2.1
  353   1   1   6 37.678  75.356   0.342    3.6     2       30.1        2.3
  354  -5   1   0 37.716  75.432   0.342    3.59    2       25.8        1.7
  355   5   1   4 37.73   75.459   0.342    3.59    2       31.2        2.5
  356   3   5   5 37.765  75.531   0.342    3.58    2       28.8        2.1
  357   2   1   6 37.78   75.56    0.342    3.58    2        2.0        0.0
  358  -3   1   4 37.783  75.565   0.342    3.58    2       62.4        9.9
  359   0   2   6 37.797  75.594   0.343    3.58    2        3.5        0.0
  360  -1  -2   4 37.953  75.907   0.344    3.55    2        7.1        0.1
  361   1   4   6 37.995  75.989   0.344    3.54    2      259.6      170.5
  362   4   5   3 38.086  76.172   0.345    3.53    2       54.3        7.4
  363   2   5   0 38.087  76.173   0.345    3.53    2       10.9        0.3
  364  -1   4   5 38.105  76.209   0.345    3.53    2      269.0      182.2
  365   0   3   6 38.125  76.251   0.345    3.52    2       55.7        7.8
  366  -5   0   1 38.225  76.449   0.346    3.51    2      307.2      236.3
  367  -1  -4   2 38.228  76.456   0.346    3.51    2      263.0      173.2
  368   0  -1   5 38.309  76.617   0.347    3.49    2       42.3        4.5
  369  -3  -4   1 38.363  76.727   0.347    3.49    2      274.3      187.3
  370  -3   2   4 38.384  76.768   0.347    3.48    2      399.4      396.5
  371  -3   4   1 38.426  76.852   0.347    3.48    2      224.6      125.2
  372  -2   4   4 38.432  76.863   0.347    3.47    2      215.1      114.8
  373   2  -3   3 38.438  76.875   0.348    3.47    2       46.7        5.4
  374   3   4   6 38.469  76.937   0.348    3.47    2      235.6      137.4
  375   2  -1   5 38.49   76.98    0.348    3.47    2       14.0        0.5
  376   5  -1   2 38.518  77.036   0.348    3.46    2       14.2        0.5
  377   5   4   3 38.536  77.071   0.348    3.46    2      229.8      130.4
  378  -4  -2   2 38.545  77.089   0.348    3.46    2      400.5      395.9
  379  -2   2   5 38.562  77.125   0.348    3.45    2      100.5       24.9
  380   4   5   4 38.572  77.145   0.349    3.45    2       30.5        2.3
  381   1  -4   2 38.617  77.234   0.349    3.45    2      232.5      132.9
  382  -5  -1   1 38.628  77.257   0.349    3.44    2       15.2        0.6
  383   4   4   0 38.674  77.347   0.349    3.44    2      211.7      110.0
  384  -3  -2   3 38.731  77.462   0.35     3.43    2      104.7       26.8
  385  -2   1   5 38.843  77.687   0.351    3.41    2       14.3        0.5
  386  -3   0   4 38.896  77.793   0.351    3.4     2      213.7      111.0
  387  -4   3   0 38.903  77.805   0.351    3.4     2       73.0       13.0
  388  -1   5   0 39.013  78.026   0.352    3.39    2        2.5        0.0
  389  -1   5   4 39.038  78.076   0.352    3.38    2       26.0        1.6
  390  -3   4   2 39.046  78.091   0.352    3.38    2      259.8      163.1
  391  -4   3   1 39.052  78.105   0.352    3.38    2       49.5        5.9
  392   4   5   2 39.076  78.152   0.352    3.38    2       39.8        3.8
  393   0   5   5 39.087  78.174   0.352    3.38    2       26.7        1.7
  394  -4   1   3 39.11   78.219   0.353    3.37    2        1.4        0.0
  395   4  -1   4 39.17   78.341   0.353    3.37    2        3.7        0.0
  396   0   1   6 39.181  78.362   0.353    3.36    2       40.1        3.9
  397   5   4   2 39.212  78.425   0.353    3.36    2      265.6      169.2
  398  -3   4   0 39.279  78.558   0.354    3.35    2      210.5      106.0
  399   5   4   4 39.33   78.66    0.354    3.34    2      213.6      108.8
  400  -4   0   3 39.34   78.68    0.354    3.34    2       29.0        2.0
  401   3   1   6 39.483  78.965   0.355    3.32    2        4.8        0.1
  402  -5   1   1 39.529  79.057   0.356    3.32    2       81.8       15.9
  403   1   6   3 39.725  79.449   0.357    3.29    2        1.7        0.0
  404   2   6   3 39.756  79.512   0.357    3.29    2        2.1        0.0
  405  -2  -3   3 39.928  79.856   0.359    3.26    2       30.4        2.2
  406   4   3   6 39.952  79.905   0.359    3.26    2       40.2        3.8
  407  -2   3   5 39.984  79.968   0.359    3.26    2       84.7       16.7
  408   5   3   5 40.011  80.022   0.359    3.25    2       47.0        5.1
  409   4   0   5 40.039  80.078   0.36     3.25    2      334.6      259.7
  410   5   3   0 40.112  80.223   0.36     3.24    2       22.9        1.2
  411   5   2   5 40.135  80.269   0.36     3.24    2      269.8      168.2
  412   0   4   6 40.154  80.308   0.36     3.24    2      128.5       38.2
  413   4  -2   3 40.156  80.312   0.36     3.24    2      265.3      162.6
  414   4  -3   1 40.218  80.436   0.361    3.23    2       65.1        9.8
  415   2   6   4 40.271  80.542   0.361    3.22    2      263.5      159.7
  416  -2   5   2 40.272  80.545   0.361    3.22    2       89.2       18.3
  417   1   6   2 40.326  80.652   0.362    3.21    2      255.4      149.7
  418  -2  -4   2 40.425  80.85    0.362    3.2     2      120.6       33.3
  419   4   2   6 40.507  81.014   0.363    3.19    2      141.7       45.8
  420   4   5   5 40.519  81.038   0.363    3.19    2       33.9        2.6
  421  -4   2   3 40.575  81.151   0.364    3.19    2       70.6       11.3
  422   3  -2   4 40.578  81.156   0.364    3.19    2      144.3       47.3
  423   1   6   4 40.582  81.165   0.364    3.18    2      133.5       40.5
  424   5   0   4 40.605  81.21    0.364    3.18    2       54.0        6.6
  425  -1  -1   5 40.607  81.214   0.364    3.18    2       59.3        8.0
  426  -2   5   1 40.652  81.304   0.364    3.18    2       38.7        3.4
  427  -4   3   2 40.663  81.326   0.364    3.18    2       69.2       10.9
  428  -3   3   4 40.677  81.355   0.364    3.17    2       29.4        2.0
  429   2   6   2 40.699  81.399   0.365    3.17    2      143.3       46.5
  430   2   5   6 40.718  81.436   0.365    3.17    2       22.2        1.1
  431  -5  -2   1 40.726  81.451   0.365    3.17    2       68.4       10.6
  432  -2   0   5 40.817  81.635   0.365    3.16    2      224.5      113.6
  433   3   5   0 40.963  81.927   0.366    3.14    2       18.1        0.7
  434   3  -1   5 40.964  81.928   0.366    3.14    2        6.6        0.1
  435   1   0   6 40.977  81.953   0.367    3.14    2       63.7        9.1
  436   4   4   6 41.087  82.173   0.367    3.13    2       17.2        0.7
  437  -1   2   6 41.102  82.205   0.367    3.13    2      132.1       39.0
  438   5  -1   3 41.108  82.215   0.368    3.13    2       69.8       10.9
  439   0  -5   1 41.108  82.217   0.368    3.13    2       42.4        4.0
  440  -3   4   3 41.119  82.239   0.368    3.13    2       76.5       13.0
  441  -1  -5   1 41.146  82.291   0.368    3.12    2       11.2        0.3
  442   2  -4   2 41.191  82.383   0.368    3.12    2        8.1        0.1
  443  -4  -1   3 41.259  82.518   0.369    3.11    2       47.4        5.0
  444   0   6   3 41.275  82.551   0.369    3.11    2      257.4      147.1
  445  -2  -2   4 41.276  82.552   0.369    3.11    2      132.3       38.8
  446   2   0   6 41.294  82.589   0.369    3.11    2      266.5      157.6
  447   5   4   1 41.341  82.683   0.369    3.1     2       82.1       14.9
  448  -2   5   3 41.347  82.694   0.369    3.1     2       64.2        9.1
  449  -5   2   0 41.367  82.735   0.369    3.1     2      236.1      123.3
  450   3   6   3 41.368  82.736   0.369    3.1     2      252.5      141.1
  451   6   2   2 41.452  82.904   0.37     3.09    2      238.4      125.5
  452   1   5   6 41.492  82.985   0.37     3.09    2       16.1        0.6
  453   4   5   1 41.512  83.025   0.37     3.08    2       50.9        5.7
  454   3   5   6 41.521  83.041   0.371    3.08    2        1.5        0.0
  455   0   6   2 41.532  83.064   0.371    3.08    2       94.0       19.5
  456   6   1   2 41.533  83.067   0.371    3.08    2       64.3        9.1
  457   3   6   4 41.539  83.078   0.371    3.08    2       97.2       20.8
  458   5   4   5 41.574  83.147   0.371    3.08    2      311.3      213.0
  459   3  -4   1 41.58   83.16    0.371    3.08    2      305.9      205.7
  460  -1   3   6 41.642  83.284   0.371    3.07    2        5.3        0.1
  461   5  -2   1 41.682  83.364   0.372    3.07    2      194.1       82.5
  462  -3  -1   4 41.686  83.372   0.372    3.07    2       15.1        0.5
  463   6   2   3 41.738  83.476   0.372    3.06    2      194.8       83.0
  464   5   1   5 41.941  83.882   0.374    3.04    2       23.2        1.2
  465   3  -3   3 42.03   84.06    0.374    3.04    2       27.6        1.7
  466   6   1   1 42.049  84.099   0.374    3.03    2       33.3        2.4
  467  -5   0   2 42.13   84.26    0.375    3.03    2      109.0       25.7
  468   0   0   6 42.233  84.465   0.376    3.02    2      168.6       61.2
  469   2   6   5 42.234  84.468   0.376    3.02    2       91.0       17.9
  470  -1   1   6 42.242  84.485   0.376    3.02    2       71.6       11.0
  471   1   6   1 42.374  84.747   0.377    3.01    2       84.1       15.2
  472   6   1   3 42.464  84.928   0.377    3.0     2       11.4        0.3
  473   0   6   4 42.466  84.932   0.377    3.0     2       54.0        6.2
  474  -2   5   0 42.478  84.956   0.377    3.0     2       74.0       11.7
  475  -5   2   1 42.5    85.0     0.378    2.99    2      268.5      154.1
  476   6   2   1 42.613  85.225   0.378    2.98    2      270.2      155.5
  477   1  -5   1 42.643  85.285   0.379    2.98    2       43.9        4.1
  478   3   6   2 42.644  85.287   0.379    2.98    2       50.0        5.3
  479  -1   5   5 42.68   85.359   0.379    2.98    2       13.2        0.4
  480   6   3   3 42.687  85.375   0.379    2.98    2       78.7       13.2
  481   2   3   7 42.705  85.409   0.379    2.98    2       12.9        0.4
  482   4   1   6 42.737  85.474   0.379    2.97    2       38.4        3.1
  483  -2  -5   1 42.754  85.508   0.379    2.97    2       60.8        7.8
  484  -5   1   2 42.765  85.53    0.38     2.97    2       33.5        2.4
  485   1   6   5 42.882  85.763   0.38     2.96    2       48.4        4.9
  486   4  -3   2 42.968  85.937   0.381    2.96    2       30.6        2.0
  487   6   3   2 43.046  86.093   0.382    2.95    2       12.2        0.3
  488   0  -3   4 43.057  86.114   0.382    2.95    2        8.4        0.1
  489  -2   4   5 43.068  86.137   0.382    2.95    2       81.9       14.1
  490   2   6   1 43.083  86.165   0.382    2.95    2       45.9        4.4
  491   5   5   3 43.085  86.17    0.382    2.95    2       39.9        3.4
  492   1  -3   4 43.135  86.27    0.382    2.94    2       11.5        0.3
  493   3   6   5 43.154  86.307   0.382    2.94    2      284.0      169.4
  494   6   0   1 43.16   86.319   0.382    2.94    2      115.1       27.8
  495  -5  -1   2 43.168  86.337   0.382    2.94    2       44.6        4.2
  496   3   0   6 43.181  86.361   0.383    2.94    2      174.5       63.9
  497  -4  -3   2 43.184  86.367   0.383    2.94    2       46.9        4.6
  498   5   5   4 43.22   86.441   0.383    2.94    2       31.6        2.1
  499   0   6   1 43.232  86.463   0.383    2.94    2      291.4      178.0
  500   6   0   2 43.289  86.578   0.383    2.93    2      243.9      124.5
  501  -4  -4   1 43.361  86.723   0.384    2.93    2       77.8       12.6
  502   1   3   7 43.378  86.757   0.384    2.93    2       38.7        3.1
  503   5  -2   2 43.439  86.877   0.384    2.92    2      271.4      153.6
  504   2   2   7 43.462  86.924   0.385    2.92    2       33.9        2.4
  505   6   2   4 43.466  86.932   0.385    2.92    2      274.2      156.8
  506   3   3   7 43.596  87.193   0.385    2.91    2        9.3        0.2
  507   1  -2   5 43.601  87.203   0.386    2.91    2       37.8        3.0
  508   2   4   7 43.618  87.236   0.386    2.91    2       83.0       14.3
  509  -4   3   3 43.701  87.403   0.386    2.9     2       49.1        5.0
  510   6   3   4 43.77   87.54    0.387    2.9     2        8.5        0.1
  511   0   5   6 43.83   87.66    0.387    2.9     2       85.3       15.0
  512  -1   4   6 43.852  87.703   0.387    2.89    2       73.0       11.0
  513  -2   5   4 43.858  87.716   0.387    2.89    2       80.9       13.5
  514   0  -4   3 43.86   87.721   0.387    2.89    2       77.1       12.3
  515   4   5   6 43.886  87.772   0.388    2.89    2       58.6        7.1
  516   1   2   7 43.918  87.837   0.388    2.89    2      354.7      259.5
  517   6   1   0 44.005  88.01    0.388    2.88    2       41.2        3.5
  518   0  -2   5 44.078  88.156   0.389    2.88    2      353.2      256.5
  519  -3  -4   2 44.16   88.32    0.389    2.87    2       72.7       10.9
  520  -3  -3   3 44.225  88.449   0.39     2.87    2        1.8        0.0
  521   3   4   7 44.292  88.584   0.39     2.87    2      244.4      122.3
  522  -1   6   2 44.296  88.592   0.39     2.87    2      140.5       40.4
  523   5   3   6 44.33   88.661   0.391    2.86    2       19.9        0.8
  524   4   6   4 44.364  88.728   0.391    2.86    2      151.0       46.6
  525  -1   6   3 44.379  88.759   0.391    2.86    2      211.2       91.1
  526   5   5   2 44.389  88.779   0.391    2.86    2       30.5        1.9
  527  -2  -1   5 44.441  88.882   0.391    2.86    2       58.7        7.0
  528  -5  -3   1 44.469  88.938   0.392    2.86    2       35.4        2.6
  529   6   0   0 44.47   88.94    0.392    2.86    2       79.4       12.9
  530   1  -4   3 44.493  88.987   0.392    2.86    2      246.4      123.7
  531   1   4   7 44.507  89.014   0.392    2.85    2      156.8       50.1
  532   4   6   3 44.533  89.065   0.392    2.85    2      220.5       99.0
  533  -1  -3   4 44.542  89.085   0.392    2.85    2       55.6        6.3
  534   3   2   7 44.569  89.138   0.392    2.85    2      100.4       20.5
  535  -3   4   4 44.612  89.224   0.393    2.85    2      265.5      143.3
  536  -3   2   5 44.645  89.289   0.393    2.85    2       27.6        1.5
  537   2  -2   5 44.688  89.375   0.393    2.84    2      100.0       20.3
  538  -3   1   5 44.703  89.405   0.393    2.84    2       52.6        5.6
  539   2  -3   4 44.777  89.554   0.394    2.84    2        4.2        0.0
  540  -1  -4   3 44.79   89.581   0.394    2.84    2      157.3       50.1
  541   5   5   5 44.795  89.589   0.394    2.84    2       27.3        1.5
  542  -4  -2   3 44.829  89.659   0.394    2.84    2       27.0        1.5
  543   6   1   4 44.831  89.661   0.394    2.84    2       32.6        2.2
  544   6   3   1 44.844  89.687   0.394    2.84    2       59.6        7.2
  545   6   0   3 44.857  89.714   0.394    2.84    2      173.8       61.1
  546   5   4   0 44.889  89.777   0.395    2.83    2      273.9      151.8
  547  -4   1   4 44.895  89.79    0.395    2.83    2       71.5       10.3
  548   4  -1   5 44.971  89.942   0.395    2.83    2       24.5        1.2


  X-ray diffraction powder data (I)...X-Ray wave length =  1.78892 (angs.):

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

    1   0   0   1   6.432  12.864  7.98455     1210.1     33.8     34.1     5.6
    2   1   0   0   6.705  13.41   7.66093      209.0      5.8      5.9     5.6
    3   0   1   0   6.928  13.856  7.41535      246.3      6.9      6.9     5.6
    4   0   1   1   7.244  14.489  7.09325       88.6      2.5      2.5     5.6
    5   1   1   1   8.101  16.201  6.34759      305.6      8.5      8.6     5.6
    6   1   0   1   8.188  16.375  6.28073     1206.7     33.7     34.0     5.6
    7  -1   0   1  10.318  20.636  4.99386      965.6     27.0     27.1     5.6
    8   1   2   1  12.727  25.453  4.06023      412.2     11.5     11.5     5.6
    9   0   0   2  12.947  25.894  3.99228     3576.3    100.0    100.0     5.6
   10   2   1   1  13.062  26.123  3.9578       122.3      3.4      3.4     5.6
   11   1   0   2  13.185  26.371  3.92134      403.1     11.3     11.3     5.6
   12  -1  -1   1  13.444  26.887  3.8473        39.8      1.1      1.1     5.6
   13   2   0   0  13.504  27.008  3.83046      544.8     15.2     15.2     5.6
   14   2   0   1  13.598  27.196  3.80439     1960.6     54.8     54.8     5.6
   15   1   2   2  13.921  27.843  3.71777     1582.0     44.2     44.2     5.6
   16   0   2   0  13.96   27.92   3.70767     1533.2     42.9     42.8     5.6
   17   0   2   2  14.608  29.216  3.54662     1118.2     31.3     31.2     5.6
   18   1   2   0  14.686  29.373  3.52802     1138.3     31.8     31.7     5.6
   19  -1   1   2  15.516  31.032  3.34369       63.3      1.8      1.8     5.6
   20  -1   2   1  15.942  31.884  3.2566      2772.6     77.5     77.2     5.6
   21   2   2   1  16.0    31.999  3.24511     2677.1     74.9     74.5     5.6
   22  -2   0   1  16.311  32.622  3.18483     2723.4     76.2     75.7     5.6
   23   2   2   2  16.369  32.738  3.1738      1286.7     36.0     35.8     5.6
   24   2   0   2  16.548  33.097  3.14037      415.2     11.6     11.5     5.6
   25   1   1   3  17.059  34.118  3.04909      135.1      3.8      3.8     5.7
   26   0  -1   2  17.17   34.339  3.03001      119.4      3.3      3.3     5.7
   27   1   2   3  17.69   35.38   2.9436        94.2      2.6      2.6     5.7
   28   1  -1   2  17.731  35.463  2.93696      127.9      3.6      3.5     5.7
   29   0  -2   1  17.77   35.54   2.93077       88.2      2.5      2.4     5.7
   30   0   1   3  17.844  35.689  2.91896       63.0      1.8      1.7     5.7
   31  -1   2   2  18.107  36.214  2.87802      241.3      6.7      6.7     5.7
   32   2   2   0  18.206  36.413  2.86281      229.3      6.4      6.4     5.7
   33   0   2   3  18.809  37.619  2.77419       68.8      1.9      1.9     5.7
   34   1   3   2  18.857  37.713  2.76749       38.5      1.1      1.1     5.7
   35  -1  -2   1  18.919  37.837  2.75876       64.5      1.8      1.8     5.7
   36   2   1   3  18.952  37.903  2.75413       90.0      2.5      2.5     5.7
   37   2   2   3  19.184  38.368  2.72204     1471.3     41.1     40.7     5.7
   38   1  -2   1  19.226  38.451  2.71634     1491.6     41.7     41.3     5.7
   39   1   0   3  19.267  38.533  2.71077      100.3      2.8      2.8     5.7
   40   0   0   3  19.638  39.275  2.66152      859.6     24.0     23.8     5.7
   41   3   0   1  20.05   40.1    2.60899       80.5      2.3      2.2     5.7
   42   2   3   2  20.463  40.927  2.55847       40.1      1.1      1.1     5.7
   43   3   0   0  20.504  41.007  2.55364     1088.5     30.4     30.0     5.7
   44   2  -1   2  20.759  41.518  2.5236        43.8      1.2      1.2     5.7
   45  -2   2   0  20.949  41.898  2.5017       231.7      6.5      6.4     5.7
   46   3   2   2  20.983  41.967  2.49782      319.6      8.9      8.8     5.7
   47  -2   2   1  21.116  42.232  2.48281      457.1     12.8     12.6     5.7
   48   3   2   1  21.192  42.384  2.47432      476.3     13.3     13.1     5.7
   49   2   0   3  21.31   42.621  2.46124      840.4     23.5     23.1     5.7
   50   3   0   2  21.764  43.529  2.4123        44.6      1.2      1.2     5.7
   51  -1   3   1  22.036  44.072  2.38402       61.1      1.7      1.7     5.7
   52  -1   2   3  22.206  44.413  2.36665     1505.3     42.1     41.4     5.7
   53  -2  -2   1  22.331  44.662  2.35413     1736.5     48.6     47.7     5.7
   54   2  -2   1  22.865  45.73   2.30197      717.3     20.1     19.7     5.7
   55   1   2   4  22.937  45.875  2.29511      985.4     27.6     27.0     5.7
   56   0  -2   2  23.041  46.082  2.28533      920.8     25.7     25.3     5.7
   57   3  -1   1  23.155  46.309  2.27475       48.2      1.3      1.3     5.7
   58   2   2   4  23.705  47.41   2.22486      146.1      4.1      4.0     5.7
   59   1  -2   2  23.779  47.557  2.21837      151.6      4.2      4.2     5.7
   60   3   3   2  24.14   48.28   2.18711       80.2      2.2      2.2     5.7
   61   0   2   4  24.305  48.609  2.17319      271.7      7.6      7.4     5.7
   62  -1  -2   2  24.431  48.863  2.16261      280.4      7.8      7.7     5.7
   63   1   4   2  25.114  50.229  2.10746     1672.4     46.8     45.7     5.8
   64   3   0   3  25.293  50.585  2.09358      417.2     11.7     11.4     5.8
   65   3  -1   2  25.531  51.062  2.0753        78.4      2.2      2.1     5.8
   66   1   0   4  25.902  51.804  2.04761      200.3      5.6      5.5     5.8
   67   0   4   2  26.09   52.18   2.03385       50.3      1.4      1.4     5.8
   68   2   4   2  26.142  52.284  2.03011       47.5      1.3      1.3     5.8
   69   1  -3   1  26.289  52.577  2.01958       40.1      1.1      1.1     5.8
   70   4   1   2  26.433  52.866  2.00935       44.1      1.2      1.2     5.8
   71   3   2   4  26.467  52.934  2.00694      253.0      7.1      6.9     5.8
   72   2  -2   2  26.51   53.019  2.00396      217.5      6.1      5.9     5.8
   73   0   0   4  26.622  53.243  1.99614      376.4     10.5     10.2     5.8
   74  -2   0   3  26.77   53.54   1.98587      609.9     17.1     16.6     5.8
   75  -3   2   0  26.818  53.637  1.98256      477.7     13.4     13.0     5.8
   76   4   2   2  26.872  53.744  1.9789       473.3     13.2     12.9     5.8
   77   4   0   1  27.068  54.135  1.96567      309.1      8.6      8.4     5.8
   78  -3   0   2  27.154  54.308  1.9599       568.5     15.9     15.4     5.8
   79  -2   2   3  27.204  54.407  1.95658      102.9      2.9      2.8     5.8
   80  -3  -2   1  27.336  54.672  1.94784      111.2      3.1      3.0     5.8
   81  -3   2   1  27.373  54.746  1.94539      383.7     10.7     10.4     5.8
   82   4   2   1  27.461  54.921  1.93967      209.1      5.8      5.7     5.8
   83   2   4   1  27.49   54.98   1.93777      102.6      2.9      2.8     5.8
   84  -1   2   4  27.568  55.137  1.93269       96.7      2.7      2.6     5.8
   85  -2  -2   2  27.709  55.418  1.92365       94.5      2.6      2.6     5.8
   86   4   0   0  27.841  55.683  1.91523      345.0      9.6      9.4     5.8
   87   4   0   2  28.049  56.098  1.9022       579.4     16.2     15.7     5.8
   88   1   4   4  28.614  57.227  1.86774      496.9     13.9     13.4     5.8
   89   1   4   0  28.748  57.496  1.85974      540.9     15.1     14.6     5.8
   90   0   4   0  28.848  57.696  1.85384       38.5      1.1      1.0     5.8
   91  -1   4   1  29.01   58.021  1.84437      396.3     11.1     10.7     5.8
   92   3   4   3  29.04   58.08   1.84265      370.8     10.4     10.0     5.8
   93   1   2   5  29.101  58.201  1.83914      126.9      3.5      3.4     5.8
   94   0  -2   3  29.222  58.444  1.83219      157.3      4.4      4.2     5.8
   95   1  -2   3  29.456  58.911  1.81893       41.5      1.2      1.1     5.8
   96  -3   2   2  29.625  59.25   1.80947      470.9     13.2     12.7     5.8
   97   4   2   0  29.741  59.482  1.80306      468.8     13.1     12.6     5.8
   98  -4   0   1  30.281  60.562  1.77387       72.4      2.0      1.9     5.8
   99  -1   4   3  30.514  61.028  1.76163      427.1     11.9     11.5     5.8
  100   4   0   3  30.674  61.348  1.75331      874.7     24.5     23.5     5.8
  101   3   4   4  30.722  61.444  1.75086      100.5      2.8      2.7     5.8
  102  -1   4   0  30.758  61.515  1.74902       96.4      2.7      2.6     5.8
  103  -1  -2   3  30.795  61.59   1.74711       45.5      1.3      1.2     5.8
  104   3  -2   2  30.862  61.724  1.74368      274.2      7.7      7.4     5.8
  105   3   2   5  31.402  62.804  1.71668       53.4      1.5      1.4     5.9
  106   2  -2   3  31.472  62.944  1.71326       59.6      1.7      1.6     5.9
  107  -2   2   4  32.345  64.69   1.67185       64.3      1.8      1.7     5.9
  108  -3   3   0  32.433  64.866  1.6678        42.7      1.2      1.1     5.9
  109  -3  -2   2  32.495  64.99   1.66496      106.8      3.0      2.9     5.9
  110   2   5   3  32.588  65.176  1.66074       44.3      1.2      1.2     5.9
  111   1   4   5  32.684  65.367  1.65641      154.1      4.3      4.1     5.9
  112  -1  -4   1  32.87   65.74   1.64806      151.7      4.2      4.1     5.9
  113   1   0   5  33.077  66.155  1.63889       63.4      1.8      1.7     5.9
  114  -2   4   2  33.32   66.641  1.6283       246.2      6.9      6.6     5.9
  115  -2   0   4  33.368  66.736  1.62625       57.9      1.6      1.5     5.9
  116   4   4   2  33.454  66.908  1.62256      222.7      6.2      5.9     5.9
  117  -4   2   0  33.618  67.235  1.61557      112.4      3.1      3.0     5.9
  118   5   2   2  33.687  67.373  1.61265       93.7      2.6      2.5     5.9
  119   2   0   5  33.788  67.575  1.60841      283.8      7.9      7.6     5.9
  120  -1   2   5  33.873  67.745  1.60485      173.6      4.9      4.6     5.9
  121   3   4   5  33.922  67.845  1.60278      255.1      7.1      6.8     5.9
  122   1  -4   1  34.017  68.035  1.59883      424.1     11.9     11.3     5.9
  123   0   0   5  34.064  68.128  1.59691       53.1      1.5      1.4     5.9
  124  -4   0   2  34.173  68.347  1.59242      296.9      8.3      7.9     5.9
  125   0   4   5  34.608  69.215  1.57488      110.2      3.1      2.9     5.9
  126   4   0   4  34.726  69.452  1.57018      126.8      3.5      3.4     5.9
  127  -2  -4   1  34.833  69.666  1.56598      102.6      2.9      2.7     5.9
  128   4   2   5  35.053  70.105  1.5574        79.1      2.2      2.1     5.9
  129   3  -2   3  35.097  70.194  1.55568       78.2      2.2      2.1     5.9
  130   5   0   2  35.183  70.367  1.55236       80.7      2.3      2.1     5.9
  131   5   0   0  35.717  71.434  1.53219       97.7      2.7      2.6     5.9
  132   2   2   6  35.924  71.847  1.52455       85.6      2.4      2.3     5.9
  133   1   2   6  36.047  72.095  1.52001      285.8      8.0      7.5     5.9
  134   0  -2   4  36.185  72.371  1.51501      200.0      5.6      5.3     5.9
  135   5   2   4  36.538  73.075  1.50241       92.4      2.6      2.4     6.0
  136  -1   0   5  36.683  73.365  1.4973       271.9      7.6      7.2     6.0
  137   4   4   5  37.005  74.009  1.48611      111.5      3.1      2.9     6.0
  138   2  -4   1  37.054  74.107  1.48442      109.4      3.1      2.9     6.0
  139   5  -1   1  37.375  74.75   1.47351       40.0      1.1      1.1     6.0
  140   3   2   6  37.431  74.862  1.47162      300.7      8.4      7.9     6.0
  141   2  -2   4  37.525  75.05   1.46848      230.9      6.5      6.1     6.0
  142   0  -4   2  37.618  75.236  1.46539       58.3      1.6      1.5     6.0
  143   1   4   6  37.995  75.989  1.45302      170.5      4.8      4.5     6.0
  144  -1   4   5  38.105  76.209  1.44946      197.7      5.5      5.2     6.0
  145  -5   0   1  38.225  76.449  1.4456       409.5     11.5     10.7     6.0
  146  -3   2   4  38.384  76.768  1.44052      583.8     16.3     15.3     6.0
  147  -3   4   1  38.426  76.852  1.43919      245.4      6.9      6.4     6.0
  148   3   4   6  38.469  76.937  1.43784      137.9      3.9      3.6     6.0
  149  -4  -2   2  38.545  77.089  1.43545      553.6     15.5     14.5     6.0
  150   1  -4   2  38.617  77.234  1.43317      133.5      3.7      3.5     6.0
  151   4   4   0  38.674  77.347  1.43141      110.0      3.1      2.9     6.0
  152  -3   0   4  38.896  77.793  1.4245       124.0      3.5      3.2     6.0
  153  -4   3   1  39.052  78.105  1.41971      176.1      4.9      4.6     6.0
  154   5   4   2  39.212  78.425  1.41484      169.2      4.7      4.4     6.0
  155  -3   4   0  39.279  78.558  1.41284      106.0      3.0      2.8     6.0
  156   5   4   4  39.33   78.66   1.41129      110.8      3.1      2.9     6.0
  157   4   0   5  40.039  80.078  1.3904       259.7      7.3      6.7     6.0
  158   4  -2   3  40.156  80.312  1.38703      370.2     10.4      9.6     6.0
  159   2   6   4  40.271  80.542  1.38374      178.0      5.0      4.6     6.1
  160   1   6   2  40.326  80.652  1.38218      149.7      4.2      3.9     6.1
  161   4   2   6  40.507  81.014  1.37707       48.4      1.4      1.3     6.1
  162   1   6   4  40.582  81.165  1.37495      113.8      3.2      2.9     6.1
  163   2   6   2  40.699  81.399  1.37168       58.2      1.6      1.5     6.1
  164  -2   0   5  40.817  81.635  1.36841      113.6      3.2      2.9     6.1
  165  -1   2   6  41.102  82.205  1.36059       66.9      1.9      1.7     6.1
  166  -2  -2   4  41.276  82.552  1.35588      348.5      9.7      9.0     6.1
  167   3   6   3  41.368  82.736  1.35341      288.5      8.1      7.4     6.1
  168   6   2   2  41.452  82.904  1.35116      125.5      3.5      3.2     6.1
  169   3   6   4  41.539  83.078  1.34885       55.1      1.5      1.4     6.1
  170   5   4   5  41.574  83.147  1.34793      418.7     11.7     10.8     6.1
  171   5  -2   1  41.682  83.364  1.34507       83.0      2.3      2.1     6.1
  172   6   2   3  41.738  83.476  1.34359       83.0      2.3      2.1     6.1
  173   0   0   6  42.233  84.465  1.33076       90.1      2.5      2.3     6.1
  174  -5   2   1  42.5    85.0    1.32397      172.0      4.8      4.4     6.1
  175   6   2   1  42.613  85.225  1.32113      159.6      4.5      4.1     6.1
  176   3   6   5  43.154  86.307  1.30777      270.0      7.5      6.9     6.1
  177   0   6   1  43.232  86.463  1.30588      180.1      5.0      4.6     6.1
  178   6   0   2  43.289  86.578  1.30449      124.5      3.5      3.2     6.1
  179   6   2   4  43.466  86.932  1.30023      312.8      8.7      8.0     6.1
  180   0   5   6  43.83   87.66   1.2916        51.8      1.4      1.3     6.2
  181   1   2   7  43.918  87.837  1.28953      259.5      7.3      6.6     6.2
  182   0  -2   5  44.078  88.156  1.28581      256.5      7.2      6.5     6.2
  183   3   4   7  44.292  88.584  1.28088      162.6      4.5      4.1     6.2
  184  -1   6   3  44.379  88.759  1.27888      139.7      3.9      3.5     6.2
  185   1  -4   3  44.493  88.987  1.27629      196.3      5.5      5.0     6.2
  186   4   6   3  44.533  89.065  1.2754       105.3      2.9      2.7     6.2
  187  -3   4   4  44.612  89.224  1.27361      143.3      4.0      3.6     6.2
  188  -1  -4   3  44.79   89.581  1.26961       51.6      1.4      1.3     6.2
  189   6   0   3  44.857  89.714  1.26813       72.0      2.0      1.8     6.2
  190   5   4   0  44.889  89.777  1.26742      162.1      4.5      4.1     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)