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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MELANTERITE

3, syn, f-hexahydrite, g-melanterite

(Fe,Cu)SO(4).7H(2)O


Monoclinic  P 2(1)/c  Z = 4

R =0.088          NR =2815

20 .9 .1904

Ref.Str.:

         R.C. Peterson (2001)

         * Canad. Mineral., 41, 937-949

Reserv:

         See U(eq) in the original.    D.T.N.

                   Initial data from BDM-file 

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

             a =  14.04     alpha =   90.0 
             b =   6.502    beta  =  105.81
             c =  10.952    gamma =   90.0 

    Unit cell volume (cub. angs.) =   961.97

    Molar volume ( cub.cm/mol.) =   144.86

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

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

   1 0.0     0.0     0.0      0.0    Fe    = 1.00
   2 0.5     0.0     0.5      0.0    Fe    = 1.00
   3 0.7732  0.9711  0.3237   0.0    S     = 1.00
   4 0.796   0.9707  0.4638   0.0    O     = 1.00
   5 0.8634  0.0368  0.2891   0.0    O     = 1.00
   6 0.6918  0.116   0.2727   0.0    O     = 1.00
   7 0.7447  0.764   0.2736   0.0    O     = 1.00
   8 0.8883  0.883   0.0688   0.0    H(2)O = 1.00
   9 0.1008  0.9557  0.183    0.0    H(2)O = 1.00
  10 0.9694  0.2964  0.0679   0.0    H(2)O = 1.00
  11 0.5198  0.9573  0.3193   0.0    H(2)O = 1.00
  12 0.4311  0.2862  0.4411   0.0    H(2)O = 1.00
  13 0.3534  0.8593  0.4401   0.0    H(2)O = 1.00
  14 0.3632  0.0056  0.1148   0.0    H(2)O = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.0        0.0        0.0   
     2       2     0.5        0.0        0.5   
     3       3     0.7732     0.9711     0.3237
     4       4     0.796      0.9707     0.4638
     5       5     0.8634     0.0368     0.2891
     6       6     0.6918     0.116      0.2727
     7       7     0.7447     0.764      0.2736
     8       8     0.8883     0.883      0.0688
     9       9     0.1008     0.9557     0.183 
    10      10     0.9694     0.2964     0.0679
    11      11     0.5198     0.9573     0.3193
    12      12     0.4311     0.2862     0.4411
    13      13     0.3534     0.8593     0.4401
    14      14     0.3632     0.0056     0.1148
    15       1     0.0        0.5        0.5   
    16       2     0.5        0.5        0.0   
    17       3     0.2268     0.4711     0.1763
    18       4     0.204      0.4707     0.0362
    19       5     0.1366     0.5368     0.2109
    20       6     0.3082     0.616      0.2273
    21       7     0.2553     0.264      0.2264
    22       8     0.1117     0.383      0.4312
    23       9     0.8992     0.4557     0.317 
    24      10     0.0306     0.7964     0.4321
    25      11     0.4802     0.4573     0.1807
    26      12     0.5689     0.7862     0.0589
    27      13     0.6466     0.3593     0.0599
    28      14     0.6368     0.5056     0.3852
    29       3     0.7732     0.5289     0.8237
    30       4     0.796      0.5293     0.9638
    31       5     0.8634     0.4632     0.7891
    32       6     0.6918     0.384      0.7727
    33       7     0.7447     0.736      0.7736
    34       8     0.8883     0.617      0.5688
    35       9     0.1008     0.5443     0.683 
    36      10     0.9694     0.2036     0.5679
    37      11     0.5198     0.5427     0.8193
    38      12     0.4311     0.2138     0.9411
    39      13     0.3534     0.6407     0.9401
    40      14     0.3632     0.4944     0.6148
    41       3     0.2268     0.0289     0.6763
    42       4     0.204      0.0293     0.5362
    43       5     0.1366     0.9632     0.7109
    44       6     0.3082     0.884      0.7273
    45       7     0.2553     0.236      0.7264
    46       8     0.1117     0.117      0.9312
    47       9     0.8992     0.0443     0.817 
    48      10     0.0306     0.7036     0.9321
    49      11     0.4802     0.0427     0.6807
    50      12     0.5689     0.7138     0.5589
    51      13     0.6466     0.1407     0.5599
    52      14     0.6368     0.9944     0.8852


X-ray density (g/cm cub.)   =      1.92

MU (1/cm) =      73.807    Mass attenuation coefficient (cm**2/g) =     38.462

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

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

    1    Fe                  2.76         6
                                                 2.0615       8
                                                 2.1348       9
                                                 2.1508      10
                                                 2.0615       8
                                                 2.1348       9
                                                 2.1508      10
    2    Fe                  2.76         6
                                                 2.0906      11
                                                 2.1154      12
                                                 2.1836      13
                                                 2.0906      11
                                                 2.1154      12
                                                 2.1836      13
    3    S                   2.148        4
                                                 1.4796       4
                                                 1.4803       5
                                                 1.469        6
                                                 1.4679       7
    4    O                   3.432        6
                                                 2.3932       5
                                                 2.3968       6
                                                 2.418        7
                                                 2.7347       8
                                                 2.8298      10
                                                 2.8164      13
    5    O                   3.432        7
                                                 2.3932       4
                                                 2.422        6
                                                 2.4079       7
                                                 2.7209       8
                                                 2.7714       9
                                                 2.8989      10
                                                 3.1997      10
    6    O                   3.432        8
                                                 2.3968       4
                                                 2.422        5
                                                 2.4054       7
                                                 2.7979      11
                                                 3.295       12
                                                 2.7443      13
                                                 3.0083      14
                                                 3.3778      13
    7    O                   3.432        6
                                                 2.418        4
                                                 2.4079       5
                                                 2.4054       6
                                                 2.8962       9
                                                 2.912       12
                                                 2.7605      14
    8    H(2)O               3.6          8
                                                 2.7209       5
                                                 3.4869       7
                                                 2.9421       9
                                                 2.9202      10
                                                 2.7347       4
                                                 3.4466       7
                                                 2.993        9
                                                 3.037       10
    9    H(2)O               3.6          8
                                                 2.9421       8
                                                 2.9381      10
                                                 2.7714       5
                                                 3.581        6
                                                 2.8962       7
                                                 3.3094      10
                                                 2.993        8
                                                 3.1198      10
   10    H(2)O               3.6         11
                                                 3.5913       5
                                                 2.9202       8
                                                 2.9381       9
                                                 3.5885       4
                                                 2.8989       5
                                                 3.3094       9
                                                 2.8298       4
                                                 3.1997       5
                                                 3.037        8
                                                 3.1198       9
                                                 3.2644      10
   11    H(2)O               3.6         11
                                                 2.7979       6
                                                 3.5583       7
                                                 2.968       12
                                                 3.0494      13
                                                 2.6955      14
                                                 3.5668      11
                                                 3.5668      11
                                                 3.3042      12
                                                 3.3465      14
                                                 2.9803      12
                                                 2.9964      13
   12    H(2)O               3.6         10
                                                 2.968       11
                                                 2.9813      13
                                                 3.295        6
                                                 2.912        7
                                                 3.3042      11
                                                 3.4226      14
                                                 2.7108      14
                                                 2.9803      11
                                                 3.4318      12
                                                 3.0979      13
   13    H(2)O               3.6          9
                                                 3.0494      11
                                                 2.9813      12
                                                 2.7443       6
                                                 3.5415       7
                                                 3.0274      14
                                                 2.8164       4
                                                 3.3778       6
                                                 2.9964      11
                                                 3.0979      12
   14    H(2)O               3.6          7
                                                 2.6955      11
                                                 3.0083       6
                                                 2.7605       7
                                                 3.3465      11
                                                 3.4226      12
                                                 2.7108      12
                                                 3.0274      13

  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   1   0   0  3.796   7.593   0.037  453.2     2        7.3        5.2
    2   2   0   0  7.61   15.22    0.074  111.1     2       37.3       33.3
    3   1   1   0  8.782  17.564   0.085   82.87    4       19.8       14.1
    4   0   1   1  9.302  18.605   0.09    73.61    4       41.5       54.8
    5   1   0  -2  9.472  18.943   0.092   70.93    2       77.7       92.5
    6   1   1  -1  9.537  19.074   0.093   69.93    4       25.7       19.9
    7   0   0   2  9.774  19.548   0.095   66.48    2       52.0       38.9
    8   1   1   1 10.558  21.117   0.102   56.66    4      171.1      717.3
    9   2   0  -2 10.642  21.285   0.103   55.74    2      179.4      387.8
   10   2   1   0 11.008  22.016   0.107   51.95    4        8.5        1.6
   11   2   1  -1 11.172  22.344   0.108   50.38    4       12.9        3.6
   12   1   0   2 11.438  22.877   0.111   47.96    2       78.5       64.0
   13   3   0   0 11.457  22.915   0.111   47.8     2       24.5        6.2
   14   1   1  -2 12.385  24.771   0.12    40.6     4       11.3        2.2
   15   0   1   2 12.621  25.242   0.122   39.02    4       13.1        2.9
   16   2   1   1 12.893  25.787   0.125   37.31    4       71.5       82.4
   17   3   0  -2 12.908  25.816   0.125   37.22    2       29.8        7.2
   18   2   1  -2 13.314  26.628   0.129   34.86    4       16.1        3.9
   19   3   1  -1 13.738  27.476   0.133   32.62    4      176.1      437.5
   20   1   1   2 13.967  27.933   0.135   31.5     4        2.9        0.1
   21   3   1   0 13.982  27.965   0.135   31.42    4       18.4        4.6
   22   2   0   2 14.01   28.02    0.135   31.29    2      134.9      123.1
   23   3   1  -2 15.209  30.419   0.147   26.25    4        6.9        0.5
   24   4   0   0 15.358  30.716   0.148   25.71    2       88.2       43.3
   25   4   0  -2 15.836  31.672   0.153   24.07    2        9.0        0.4
   26   3   1   1 15.87   31.739   0.153   23.96    4       51.8       27.8
   27   0   2   0 15.97   31.94    0.154   23.64    2      180.3      166.1
   28   2   1   2 16.167  32.335   0.156   23.02    4        1.5        0.0
   29   1   1  -3 16.32   32.641   0.157   22.55    4      103.4      104.2
   30   1   2   0 16.439  32.877   0.158   22.2     4       12.1        1.4
   31   0   2   1 16.734  33.468   0.161   21.36    4       38.2       13.5
   32   2   1  -3 16.737  33.474   0.161   21.35    4       72.1       48.0
   33   0   1   3 16.824  33.648   0.162   21.11    4       38.3       13.4
   34   4   1  -1 16.85   33.701   0.162   21.04    4       17.1        2.7
   35   1   2  -1 16.871  33.742   0.162   20.99    4       33.2       10.0
   36   3   0   2 17.12   34.239   0.165   20.33    2       88.2       34.2
   37   4   1   0 17.364  34.729   0.167   19.71    4       71.9       44.1
   38   1   2   1 17.493  34.985   0.168   19.39    4       17.1        2.5
   39   2   2   0 17.779  35.558   0.171   18.72    4       32.7        8.7
   40   4   1  -2 17.794  35.588   0.171   18.68    4       56.3       25.6
   41   2   2  -1 17.885  35.77    0.172   18.48    4        6.5        0.3
   42   3   1  -3 18.017  36.034   0.173   18.18    4       33.2        8.7
   43   1   1   3 18.179  36.359   0.174   17.83    4       29.5        6.7
   44   1   2  -2 18.699  37.397   0.179   16.75    4       79.3       45.6
   45   0   2   2 18.862  37.724   0.181   16.44    4       23.4        3.9
   46   3   1   2 18.961  37.922   0.182   16.25    4       63.9       28.7
   47   2   2   1 19.053  38.106   0.182   16.07    4       33.8        8.0
   48   1   0  -4 19.132  38.263   0.183   15.93    2      115.6       46.0
   49   5   0  -2 19.167  38.334   0.184   15.86    2       79.4       21.6
   50   2   0  -4 19.215  38.43    0.184   15.78    2       16.1        0.9
   51   4   1   1 19.234  38.469   0.184   15.74    4      109.0       80.8
   52   5   0   0 19.333  38.667   0.185   15.56    2        8.2        0.2
   53   2   2  -2 19.352  38.704   0.185   15.53    4       37.3        9.4
   54   3   2  -1 19.658  39.317   0.188   15.0     4       20.5        2.7
   55   1   2   2 19.826  39.651   0.19    14.72    4       87.3       48.5
   56   3   2   0 19.837  39.674   0.19    14.7     4       73.4       34.2
   57   0   0   4 19.848  39.696   0.19    14.68    2      102.6       33.4
   58   4   1  -3 20.017  40.033   0.191   14.41    4       93.6       54.6
   59   3   0  -4 20.09   40.18    0.192   14.29    2       64.9       13.0
   60   2   1   3 20.24   40.479   0.193   14.06    4       32.1        6.3
   61   5   1  -1 20.305  40.61    0.194   13.96    4        3.4        0.1
   62   4   0   2 20.572  41.143   0.196   13.56    2       65.6       12.6
   63   3   2  -2 20.757  41.514   0.198   13.29    4       45.8       12.1
   64   1   1  -4 20.82   41.641   0.199   13.2     4       26.3        3.9
   65   5   1  -2 20.854  41.707   0.199   13.15    4       48.0       13.1
   66   2   1  -4 20.898  41.796   0.199   13.09    4        0.0        0.0
   67   5   1   0 21.009  42.017   0.2     12.93    4       52.3       15.3
   68   3   2   1 21.266  42.532   0.203   12.59    4       72.2       28.3
   69   1   0   4 21.297  42.594   0.203   12.55    2      130.1       45.9
   70   0   1   4 21.49   42.98    0.205   12.29    4        2.1        0.0
   71   2   2   2 21.498  42.997   0.205   12.28    4       33.1        5.8
   72   1   2  -3 21.619  43.238   0.206   12.13    4       25.9        3.5
   73   4   0  -4 21.676  43.352   0.206   12.06    2       88.2       20.3
   74   3   1  -4 21.717  43.433   0.207   12.01    4       65.8       22.5
   75   2   2  -3 21.948  43.897   0.209   11.72    4        1.2        0.0
   76   0   2   3 22.018  44.035   0.21    11.64    4       78.4       30.9
   77   4   2  -1 22.039  44.077   0.21    11.62    4       40.2        8.1
   78   4   1   2 22.169  44.339   0.211   11.46    4       20.0        2.0
   79   4   2   0 22.451  44.902   0.213   11.14    4       53.1       13.6
   80   5   1  -3 22.58   45.16    0.215   11.0     4       40.7        7.9
   81   6   0  -2 22.778  45.557   0.216   10.78    2      112.3       29.4
   82   4   2  -2 22.8    45.599   0.217   10.76    4       69.4       22.4
   83   3   1   3 22.85   45.699   0.217   10.71    4       37.5        6.5
   84   1   1   4 22.854  45.707   0.217   10.7     4       31.4        4.6
   85   5   1   1 22.87   45.74    0.217   10.69    4       73.2       24.8
   86   3   2  -3 22.981  45.963   0.218   10.57    4       42.2        8.1
   87   1   2   3 23.115  46.23    0.219   10.43    4       10.5        0.5
   88   4   1  -4 23.213  46.425   0.22    10.33    4        2.1        0.0
   89   2   0   4 23.368  46.735   0.222   10.18    2       65.6        9.5
   90   6   0   0 23.408  46.816   0.222   10.14    2       57.7        7.3
   91   3   2   2 23.761  47.523   0.225    9.8     4        6.0        0.2
   92   5   0  -4 23.861  47.722   0.226    9.71    2       62.8        8.3
   93   4   2   1 23.99   47.979   0.227    9.59    4       15.9        1.1
   94   6   1  -1 24.011  48.023   0.227    9.57    4        1.3        0.0
   95   6   1  -2 24.26   48.52    0.23     9.35    4       70.3       19.9
   96   5   0   2 24.277  48.555   0.23     9.33    2       55.2        6.1
   97   4   2  -3 24.649  49.298   0.233    9.02    4       37.7        5.5
   98   1   3   0 24.707  49.414   0.234    8.97    4       20.2        1.6
   99   2   1   4 24.823  49.645   0.235    8.87    4        9.4        0.3
  100   2   2   3 24.839  49.677   0.235    8.86    4        6.6        0.2
  101   6   1   0 24.861  49.722   0.235    8.84    4       29.6        3.3
  102   5   2  -1 24.894  49.789   0.235    8.81    4        9.9        0.4
  103   0   3   1 24.919  49.838   0.236    8.79    4       11.1        0.5
  104   1   3  -1 25.018  50.036   0.236    8.72    4       56.3       11.9
  105   5   1  -4 25.294  50.589   0.239    8.5     4       21.2        1.7
  106   1   2  -4 25.335  50.671   0.239    8.47    4        6.3        0.1
  107   5   2  -2 25.364  50.728   0.239    8.45    4       30.4        3.4
  108   2   2  -4 25.402  50.804   0.24     8.42    4       42.3        6.5
  109   1   3   1 25.473  50.946   0.24     8.37    4       87.0       27.3
  110   5   2   0 25.497  50.994   0.241    8.35    4        7.0        0.2
  111   2   1  -5 25.546  51.091   0.241    8.31    4       15.5        0.9
  112   6   1  -3 25.583  51.167   0.241    8.28    4        7.1        0.2
  113   2   3   0 25.685  51.37    0.242    8.21    4       32.7        3.8
  114   5   1   2 25.694  51.387   0.242    8.2     4        0.6        0.0
  115   1   1  -5 25.704  51.409   0.242    8.19    4       78.2       21.6
  116   2   3  -1 25.764  51.529   0.243    8.15    4        6.3        0.1
  117   4   1   3 25.89   51.781   0.244    8.06    4       31.6        3.5
  118   0   2   4 25.913  51.827   0.244    8.05    4       47.0        7.7
  119   3   0   4 25.95   51.901   0.245    8.02    2       34.6        2.1
  120   3   1  -5 26.029  52.058   0.245    7.96    4       76.5       20.2
  121   3   2  -4 26.11   52.22    0.246    7.91    4       10.9        0.4
  122   1   3  -2 26.378  52.757   0.248    7.73    4       89.6       26.8
  123   0   1   5 26.497  52.994   0.249    7.65    4       83.9       23.3
  124   0   3   2 26.504  53.007   0.249    7.64    4        2.4        0.0
  125   4   2   2 26.505  53.01    0.249    7.64    4      108.3       38.8
  126   6   0  -4 26.537  53.074   0.25     7.62    2      107.7       19.1
  127   7   0  -2 26.62   53.24    0.25     7.57    2       38.4        2.4
  128   2   3   1 26.65   53.3     0.251    7.55    4       45.4        6.7
  129   6   1   1 26.732  53.464   0.251    7.5     4       41.0        5.4
  130   5   2  -3 26.865  53.731   0.253    7.41    4        3.2        0.0
  131   2   3  -2 26.881  53.762   0.253    7.4     4       48.0        7.4
  132   3   2   3 27.103  54.206   0.255    7.26    4        8.0        0.2
  133   1   2   4 27.106  54.213   0.255    7.26    4       43.1        5.8
  134   3   3  -1 27.119  54.239   0.255    7.25    4      172.9       93.7
  135   5   2   1 27.121  54.242   0.255    7.25    4       32.4        3.3
  136   4   1  -5 27.13   54.26    0.255    7.25    4       27.1        2.3
  137   1   3   2 27.25   54.5     0.256    7.17    4       10.3        0.3
  138   3   3   0 27.259  54.518   0.256    7.17    4       11.1        0.4
  139   3   1   4 27.304  54.607   0.256    7.14    4       34.8        3.7
  140   4   2  -4 27.424  54.848   0.257    7.07    4       69.4       14.7
  141   7   0   0 27.613  55.225   0.259    6.96    2       44.6        3.0
  142   6   1  -4 27.871  55.741   0.261    6.82    4       41.4        5.1
  143   1   1   5 27.885  55.77    0.261    6.81    4      106.9       33.6
  144   7   1  -1 27.939  55.877   0.262    6.78    4       90.5       24.0
  145   7   1  -2 27.951  55.902   0.262    6.77    4       35.7        3.7
  146   3   3  -2 27.988  55.975   0.262    6.75    4        5.9        0.1
  147   6   2  -1 28.135  56.27    0.264    6.67    4       32.9        3.1
  148   6   0   2 28.206  56.413   0.264    6.63    2       74.1        7.9
  149   6   2  -2 28.357  56.715   0.266    6.55    4      101.0       28.9
  150   3   3   1 28.397  56.794   0.266    6.53    4      113.3       36.3
  151   2   3   2 28.585  57.17    0.267    6.44    4       28.7        2.3
  152   1   3  -3 28.683  57.366   0.268    6.39    4       65.1       11.7
  153   5   1  -5 28.8    57.6     0.269    6.33    4       89.8       22.1
  154   2   2   4 28.863  57.726   0.27     6.3     4      127.2       44.0
  155   6   2   0 28.898  57.795   0.27     6.28    4       87.4       20.7
  156   7   1   0 28.913  57.825   0.27     6.27    4       49.3        6.6
  157   7   1  -3 28.949  57.897   0.271    6.26    4       96.8       25.4
  158   2   3  -3 28.952  57.904   0.271    6.25    4        3.6        0.0
  159   4   0   4 28.958  57.917   0.271    6.25    2       98.3       13.0
  160   0   3   3 29.009  58.017   0.271    6.23    4       16.5        0.7
  161   4   3  -1 29.026  58.052   0.271    6.22    4       11.1        0.3
  162   5   1   3 29.288  58.575   0.273    6.09    4       91.3       22.0
  163   5   2  -4 29.289  58.578   0.273    6.09    4        6.5        0.1
  164   2   0  -6 29.345  58.69    0.274    6.07    2      109.6       15.8
  165   4   3   0 29.365  58.731   0.274    6.06    4       24.0        1.5
  166   6   1   2 29.489  58.979   0.275    6.0     4       18.6        0.9
  167   2   2  -5 29.517  59.034   0.275    5.99    4        1.8        0.0
  168   6   2  -3 29.551  59.102   0.276    5.97    4       23.3        1.4
  169   3   0  -6 29.582  59.164   0.276    5.96    2      125.7       20.4
  170   7   0  -4 29.625  59.25    0.276    5.94    2       66.7        5.7
  171   5   2   2 29.651  59.302   0.277    5.93    4        5.8        0.1
  172   4   3  -2 29.654  59.308   0.277    5.93    4        9.0        0.2
  173   1   2  -5 29.661  59.322   0.277    5.92    4       10.3        0.3
  174   1   0  -6 29.694  59.388   0.277    5.91    2       40.3        2.1
  175   3   3  -3 29.805  59.61    0.278    5.86    4       76.3       14.7
  176   2   1   5 29.815  59.63    0.278    5.85    4       54.3        7.4
  177   4   2   3 29.83   59.661   0.278    5.85    4       25.8        1.7
  178   1   3   3 29.916  59.833   0.279    5.81    4       68.5       11.8
  179   3   2  -5 29.956  59.913   0.279    5.79    4        4.9        0.1
  180   4   1   4 30.221  60.442   0.281    5.68    4       19.0        0.9
  181   0   2   5 30.384  60.767   0.283    5.61    4       20.0        1.0
  182   4   0  -6 30.397  60.794   0.283    5.61    2       92.6       10.4
  183   3   3   2 30.459  60.919   0.283    5.58    4       18.6        0.8
  184   2   1  -6 30.598  61.196   0.285    5.52    4        2.5        0.0
  185   6   2   1 30.599  61.198   0.285    5.52    4       17.0        0.7
  186   0   0   6 30.617  61.233   0.285    5.52    2       55.5        3.7
  187   4   3   1 30.652  61.305   0.285    5.5     4       65.3       10.2
  188   8   0  -2 30.684  61.367   0.285    5.49    2       24.6        0.7
  189   7   1   1 30.813  61.626   0.286    5.44    4      107.9       27.4
  190   3   1  -6 30.829  61.658   0.286    5.43    4       24.0        1.4
  191   7   1  -4 30.871  61.742   0.287    5.42    4        2.8        0.0
  192   1   1  -6 30.938  61.876   0.287    5.39    4        7.2        0.1
  193   4   2  -5 30.965  61.929   0.288    5.38    4       17.6        0.7
  194   6   1  -5 30.983  61.966   0.288    5.37    4       16.4        0.6
  195   3   2   4 31.124  62.249   0.289    5.32    4       31.4        2.3
  196   4   3  -3 31.214  62.427   0.29     5.29    4       10.8        0.3
  197   2   3   3 31.376  62.752   0.291    5.23    4       14.5        0.5
  198   5   3  -1 31.424  62.847   0.291    5.21    4       38.4        3.3
  199   4   1  -6 31.625  63.25    0.293    5.14    4       10.9        0.3
  200   6   2  -4 31.648  63.296   0.293    5.13    4      115.6       29.6
  201   1   2   5 31.661  63.323   0.293    5.12    4       22.6        1.1
  202   7   2  -1 31.711  63.422   0.294    5.11    4       34.4        2.6
  203   7   2  -2 31.722  63.444   0.294    5.1     4       10.3        0.2
  204   5   0  -6 31.763  63.526   0.294    5.09    2       32.2        1.1
  205   1   3  -4 31.803  63.607   0.295    5.07    4       18.4        0.7
  206   5   3  -2 31.828  63.656   0.295    5.07    4       41.9        3.8
  207   0   1   6 31.84   63.679   0.295    5.06    4        5.1        0.1
  208   2   3  -4 31.861  63.722   0.295    5.05    4       24.0        1.3
  209   8   1  -2 31.905  63.811   0.295    5.04    4       18.5        0.7
  210   5   3   0 31.943  63.887   0.296    5.03    4       19.2        0.8
  211   8   0   0 31.985  63.971   0.296    5.01    2      118.3       15.2
  212   1   0   6 32.084  64.169   0.297    4.98    2       36.4        1.4
  213   8   1  -1 32.089  64.178   0.297    4.98    4       26.5        1.5
  214   3   1   5 32.231  64.462   0.298    4.93    4      117.7       29.5
  215   0   3   4 32.304  64.609   0.299    4.9     4       11.4        0.3
  216   5   0   4 32.338  64.676   0.299    4.89    2       20.0        0.4
  217   7   0   2 32.362  64.725   0.299    4.89    2       15.9        0.3
  218   3   3  -4 32.476  64.952   0.3      4.85    4        0.8        0.0
  219   5   2  -5 32.511  65.022   0.3      4.84    4        0.8        0.0
  220   7   2   0 32.616  65.231   0.301    4.8     4       73.7       11.3
  221   8   1  -3 32.637  65.273   0.301    4.8     4       27.7        1.6
  222   7   2  -3 32.649  65.298   0.302    4.79    4        4.4        0.0
  223   4   3   2 32.821  65.643   0.303    4.74    4       58.4        7.0
  224   5   1  -6 32.962  65.925   0.304    4.7     4       23.3        1.1
  225   5   2   3 32.966  65.931   0.304    4.7     4       31.8        2.1
  226   6   1   3 33.006  66.011   0.304    4.68    4       15.0        0.5
  227   8   0  -4 33.077  66.155   0.305    4.66    2       84.6        7.2
  228   5   3  -3 33.138  66.276   0.306    4.64    4       67.0        9.0
  229   6   2   2 33.154  66.309   0.306    4.64    4       36.0        2.6
  230   8   1   0 33.18   66.36    0.306    4.63    4       14.1        0.4
  231   1   1   6 33.277  66.555   0.307    4.6     4        7.2        0.1
  232   3   3   3 33.347  66.695   0.307    4.58    4       24.3        1.2
  233   1   3   4 33.35   66.701   0.307    4.58    4       43.5        3.7
  234   5   3   1 33.363  66.727   0.307    4.58    4       79.7       12.6
  235   0   4   0 33.385  66.771   0.308    4.57    2      129.8       16.6
  236   2   2   5 33.459  66.919   0.308    4.55    4       27.5        1.5
  237   5   1   4 33.526  67.053   0.309    4.53    4       23.4        1.1
  238   7   1   2 33.55   67.1     0.309    4.52    4       23.3        1.1
  239   7   1  -5 33.627  67.255   0.31     4.5     4       95.4       17.7
  240   4   3  -4 33.631  67.263   0.31     4.5     4       22.2        1.0
  241   6   0  -6 33.644  67.289   0.31     4.5     2       19.0        0.3
  242   1   4   0 33.658  67.316   0.31     4.49    4        0.6        0.0
  243   0   4   1 33.833  67.666   0.311    4.44    4       15.0        0.4
  244   4   2   4 33.841  67.682   0.311    4.44    4       50.4        4.9
  245   1   4  -1 33.915  67.83    0.312    4.42    4       32.9        2.1
  246   2   0   6 34.06   68.12    0.313    4.38    2        1.0        0.0
  247   2   2  -6 34.195  68.391   0.314    4.35    4       90.6       15.4
  248   8   1  -4 34.252  68.505   0.315    4.33    4        9.0        0.2
  249   6   3  -1 34.264  68.528   0.315    4.33    4        5.0        0.0
  250   1   4   1 34.293  68.586   0.315    4.32    4       26.1        1.3
  251   7   2   1 34.398  68.797   0.316    4.29    4       31.6        1.8
  252   3   2  -6 34.414  68.827   0.316    4.29    4        8.4        0.1
  253   7   2  -4 34.453  68.906   0.316    4.28    4       53.8        5.4
  254   6   3  -2 34.463  68.927   0.316    4.28    4       25.1        1.2
  255   2   4   0 34.47   68.94    0.316    4.28    4       45.6        3.8
  256   1   2  -6 34.517  69.033   0.317    4.26    4       33.1        2.0
  257   2   4  -1 34.537  69.073   0.317    4.26    4        3.6        0.0
  258   6   2  -5 34.559  69.118   0.317    4.25    4       15.7        0.5
  259   6   1  -6 34.81   69.621   0.319    4.19    4       22.3        0.9
  260   2   3   4 34.917  69.835   0.32     4.16    4        9.8        0.2
  261   6   3   0 34.949  69.898   0.32     4.16    4       44.1        3.5
  262   9   0  -2 34.989  69.978   0.321    4.15    2       17.7        0.3
  263   1   4  -2 35.054  70.108   0.321    4.13    4       42.4        3.2
  264   4   1   5 35.089  70.177   0.321    4.12    4        4.3        0.0
  265   8   1   1 35.135  70.271   0.322    4.11    4        3.2        0.0
  266   0   4   2 35.16   70.32    0.322    4.11    4       34.9        2.2
  267   4   2  -6 35.167  70.333   0.322    4.11    4       82.8       12.2
  268   2   1   6 35.219  70.438   0.322    4.09    4       22.0        0.9
  269   2   4   1 35.284  70.569   0.323    4.08    4        4.4        0.0
  270   5   3  -4 35.302  70.604   0.323    4.07    4        2.4        0.0
  271   0   2   6 35.37   70.741   0.324    4.06    4      139.8       34.3
  272   8   2  -2 35.433  70.865   0.324    4.04    4       15.9        0.4
  273   2   4  -2 35.481  70.962   0.324    4.03    4       86.9       13.2
  274   2   3  -5 35.509  71.017   0.325    4.03    4       14.4        0.4
  275   6   3  -3 35.54   71.079   0.325    4.02    4       19.4        0.7
  276   8   2  -1 35.607  71.215   0.325    4.0     4       30.6        1.6
  277   5   3   2 35.63   71.261   0.326    4.0     4       22.2        0.9
  278   1   3  -5 35.639  71.279   0.326    4.0     4       76.1       10.0
  279   3   4  -1 35.685  71.37    0.326    3.99    4       34.0        2.0
  280   3   2   5 35.742  71.484   0.327    3.97    4       20.4        0.7
  281   4   3   3 35.793  71.586   0.327    3.96    4       61.2        6.4
  282   1   4   2 35.797  71.594   0.327    3.96    4       67.7        7.8
  283   3   4   0 35.805  71.609   0.327    3.96    4       37.8        2.4
  284   3   3  -5 35.908  71.816   0.328    3.94    4       53.4        4.8
  285   7   0  -6 36.005  72.01    0.329    3.92    2       58.8        2.9
  286   6   0   4 36.067  72.134   0.329    3.91    2       38.0        1.2
  287   2   1  -7 36.069  72.137   0.329    3.9     4        6.6        0.1
  288   3   1  -7 36.098  72.195   0.329    3.9     4      117.6       23.3
  289   8   2  -3 36.129  72.257   0.33     3.89    4       34.1        2.0
  290   9   1  -2 36.135  72.27    0.33     3.89    4       37.2        2.3
  291   0   3   5 36.298  72.596   0.331    3.86    4       45.1        3.4
  292   3   4  -2 36.433  72.866   0.332    3.83    4       18.1        0.5
  293   5   2  -6 36.44   72.879   0.332    3.83    4       28.4        1.3
  294   6   2   3 36.481  72.962   0.332    3.82    4        9.8        0.2
  295   9   1  -1 36.492  72.984   0.332    3.82    4       43.0        3.1
  296   6   3   1 36.495  72.99    0.332    3.82    4       51.6        4.4
  297   3   0   6 36.509  73.017   0.333    3.81    2        2.8        0.0
  298   1   1  -7 36.566  73.132   0.333    3.8     4       10.9        0.2
  299   9   0   0 36.578  73.156   0.333    3.8     2       73.9        4.5
  300   9   1  -3 36.643  73.285   0.334    3.79    4      119.4       23.3
  301   8   2   0 36.648  73.296   0.334    3.79    4       96.9       15.4
  302   4   1  -7 36.653  73.305   0.334    3.79    4       44.3        3.2
  303   8   1  -5 36.699  73.397   0.334    3.78    4       38.2        2.4
  304   1   2   6 36.741  73.481   0.334    3.77    4       19.5        0.6
  305   8   0   2 36.775  73.549   0.335    3.76    2       80.9        5.3
  306   3   4   1 36.789  73.578   0.335    3.76    4       19.1        0.6
  307   4   3  -5 36.831  73.661   0.335    3.75    4       34.1        1.9
  308   9   0  -4 36.879  73.757   0.335    3.74    2       54.2        2.4
  309   2   4   2 36.953  73.907   0.336    3.73    4       67.2        7.3
  310   3   3   4 36.978  73.955   0.336    3.72    4       21.6        0.8
  311   5   2   4 36.979  73.958   0.336    3.72    4        6.6        0.1
  312   7   2   2 37.002  74.004   0.336    3.72    4        4.9        0.0
  313   1   4  -3 37.039  74.078   0.337    3.71    4       18.0        0.5
  314   7   1   3 37.043  74.086   0.337    3.71    4       48.5        3.8
  315   7   2  -5 37.076  74.152   0.337    3.71    4       11.4        0.2
  316   7   1  -6 37.138  74.276   0.337    3.69    4       64.7        6.7
  317   6   1   4 37.2    74.399   0.338    3.68    4       48.6        3.8
  318   2   4  -3 37.275  74.55    0.339    3.67    4       18.9        0.6
  319   0   4   3 37.325  74.65    0.339    3.66    4       16.1        0.4
  320   4   4  -1 37.34   74.68    0.339    3.66    4       36.5        2.1
  321   6   3  -4 37.461  74.922   0.34     3.64    4       23.0        0.8
  322   1   3   5 37.473  74.947   0.34     3.63    4       65.4        6.7
  323   7   3  -1 37.519  75.038   0.34     3.63    4       46.3        3.4
  324   7   3  -2 37.53   75.059   0.341    3.62    4       14.3        0.3
  325   0   1   7 37.582  75.163   0.341    3.61    4       22.9        0.8
  326   3   1   6 37.636  75.272   0.341    3.61    4        5.4        0.0
  327   4   4   0 37.639  75.279   0.341    3.6     4      105.4       17.3
  328   8   2  -4 37.676  75.352   0.342    3.6     4       84.0       11.0
  329   9   1   0 37.704  75.409   0.342    3.59    4        7.6        0.1
  330   5   1  -7 37.725  75.45    0.342    3.59    4       34.2        1.8
  331   4   4  -2 37.895  75.79    0.343    3.56    4       60.5        5.6
  332   8   1   2 37.899  75.798   0.343    3.56    4       13.2        0.3
  333   9   1  -4 38.002  76.004   0.344    3.54    4       27.7        1.2
  334   3   4  -3 38.029  76.058   0.344    3.54    4       26.1        1.0
  335   1   4   3 38.128  76.256   0.345    3.52    4        0.8        0.0
  336   6   2  -6 38.213  76.427   0.346    3.51    4       23.9        0.9
  337   5   3  -5 38.262  76.525   0.346    3.5     4       63.1        6.0
  338   7   3   0 38.36   76.72    0.347    3.49    4       13.0        0.3
  339   5   1   5 38.364  76.728   0.347    3.49    4       24.3        0.9
  340   7   3  -3 38.391  76.783   0.347    3.48    4       16.9        0.4
  341   4   2   5 38.482  76.964   0.348    3.47    4       28.5        1.2
  342   8   2   1 38.527  77.054   0.348    3.46    4       20.1        0.6
  343   2   2   6 38.608  77.216   0.349    3.45    4       17.8        0.5
  344   3   4   2 38.613  77.226   0.349    3.45    4       23.0        0.8
  345   5   3   3 38.687  77.374   0.349    3.44    4       80.0        9.5
  346   4   4   1 38.786  77.572   0.35     3.42    4        8.0        0.1
  347   8   0  -6 38.819  77.639   0.35     3.42    2       59.3        2.6
  348   6   3   2 38.864  77.728   0.351    3.41    4       17.3        0.4
  349   1   1   7 39.102  78.204   0.353    3.37    4       96.1       13.5
  350   2   3   5 39.15   78.3     0.353    3.37    4       13.6        0.3
  351   4   4  -3 39.292  78.584   0.354    3.35    4       10.6        0.2
  352   6   1  -7 39.3    78.6     0.354    3.35    4       15.6        0.4
  353   4   0   6 39.408  78.816   0.355    3.33    2      112.8        9.2
  354   2   2  -7 39.43   78.861   0.355    3.33    4        8.0        0.1
  355   2   4   3 39.439  78.878   0.355    3.33    4       39.0        2.2
  356   3   2  -7 39.459  78.917   0.355    3.33    4       26.6        1.0
  357   5   4  -1 39.482  78.964   0.355    3.32    4       32.1        1.5
  358   9   2  -2 39.495  78.99    0.356    3.32    4        2.0        0.0
  359   4   3   4 39.509  79.018   0.356    3.32    4       41.3        2.5
  360  10   0  -2 39.581  79.162   0.356    3.31    2       50.8        1.8
  361   9   1   1 39.746  79.491   0.357    3.29    4       64.9        6.0
  362   1   4  -4 39.827  79.654   0.358    3.28    4        7.9        0.1
  363   9   2  -1 39.842  79.683   0.358    3.27    4       35.2        1.8
  364   2   3  -6 39.843  79.687   0.358    3.27    4       37.3        2.0
  365   5   4  -2 39.85   79.699   0.358    3.27    4        0.8        0.0
  366   2   4  -4 39.88   79.76    0.358    3.27    4       43.7        2.7
  367   1   2  -7 39.913  79.827   0.359    3.27    4       40.8        2.3
  368   8   1  -6 39.925  79.85    0.359    3.26    4       22.3        0.7
  369   5   4   0 39.955  79.909   0.359    3.26    4       46.8        3.1
  370   9   2  -3 39.988  79.976   0.359    3.26    4       38.5        2.1
  371   4   2  -7 39.998  79.996   0.359    3.25    4       13.7        0.3
  372   7   3   1 40.036  80.071   0.36     3.25    4       59.3        4.9
  373   8   2  -5 40.043  80.085   0.36     3.25    4       39.1        2.1
  374   3   3  -6 40.05   80.1     0.36     3.25    4       24.2        0.8
  375   7   3  -4 40.087  80.174   0.36     3.24    4       17.2        0.4
  376   1   3  -6 40.147  80.295   0.36     3.24    4       54.8        4.2
  377   7   0   4 40.156  80.311   0.36     3.24    2        6.7        0.0
  378   9   1  -5 40.185  80.369   0.361    3.23    4       76.3        8.1
  379   6   3  -5 40.187  80.375   0.361    3.23    4       46.9        3.1
  380   0   4   4 40.285  80.569   0.361    3.22    4       49.4        3.4
  381   7   2   3 40.378  80.756   0.362    3.21    4       23.4        0.8
  382   3   4  -4 40.442  80.884   0.363    3.2     4       11.1        0.2
  383   7   2  -6 40.471  80.941   0.363    3.2     4        6.4        0.1
  384   4   1   6 40.51   81.019   0.363    3.19    4       37.3        1.9
  385   6   2   4 40.53   81.061   0.363    3.19    4       56.0        4.3
  386  10   1  -2 40.681  81.362   0.364    3.17    4       34.7        1.7
  387   4   4   2 40.76   81.519   0.365    3.16    4       66.6        6.1
  388   4   3  -6 40.765  81.529   0.365    3.16    4       34.7        1.6
  389   3   0  -8 40.807  81.613   0.365    3.16    2       27.2        0.5
  390   0   2   7 40.903  81.806   0.366    3.15    4       48.0        3.1
  391   2   0  -8 40.956  81.912   0.366    3.14    2       69.3        3.3
  392   3   2   6 40.956  81.913   0.366    3.14    4       34.1        1.6
  393   0   3   6 40.959  81.917   0.366    3.14    4       13.1        0.2
  394  10   1  -3 40.994  81.988   0.367    3.14    4       17.4        0.4
  395   8   3  -2 41.018  82.036   0.367    3.14    4       25.5        0.9
  396   9   2   0 41.023  82.046   0.367    3.14    4       37.7        1.9
  397   5   2  -7 41.043  82.086   0.367    3.13    4       11.0        0.2
  398  10   0  -4 41.045  82.09    0.367    3.13    2        7.2        0.0
  399   5   4  -3 41.052  82.103   0.367    3.13    4        9.5        0.1
  400   2   1   7 41.114  82.227   0.368    3.13    4       10.1        0.1
  401   4   0  -8 41.165  82.33    0.368    3.12    2       21.0        0.3
  402   8   3  -1 41.185  82.37    0.368    3.12    4       29.3        1.2
  403  10   1  -1 41.203  82.405   0.368    3.12    4       39.4        2.1
  404   8   2   2 41.213  82.427   0.368    3.12    4       88.3       10.5
  405   3   4   3 41.245  82.491   0.369    3.11    4        7.9        0.1
  406   1   4   4 41.248  82.497   0.369    3.11    4       26.0        0.9
  407   7   1   4 41.252  82.504   0.369    3.11    4       26.6        1.0
  408   5   4   1 41.26   82.521   0.369    3.11    4       24.0        0.8
  409   3   3   5 41.314  82.627   0.369    3.11    4       86.2       10.0
  410   9   2  -4 41.314  82.628   0.369    3.1     4       13.6        0.2
  411   7   1  -7 41.365  82.73    0.369    3.1     4       62.3        5.2
  412   8   1   3 41.43   82.86    0.37     3.09    4       13.7        0.2
  413  10   0   0 41.462  82.925   0.37     3.09    2       53.8        1.9
  414   9   0   2 41.5    82.999   0.37     3.09    2       10.4        0.1
  415   4   4  -4 41.509  83.018   0.37     3.09    4       98.9       13.0
  416   1   0  -8 41.612  83.223   0.371    3.08    2       22.8        0.3
  417   5   2   5 41.669  83.337   0.372    3.07    4       29.1        1.1
  418   8   3  -3 41.684  83.368   0.372    3.07    4       18.1        0.4
  419   3   1  -8 41.9    83.8     0.373    3.05    4        1.3        0.0
  420   5   3  -6 41.982  83.965   0.374    3.04    4       10.7        0.2
  421   6   3   3 42.022  84.044   0.374    3.04    4       22.2        0.6
  422   5   0  -8 42.028  84.056   0.374    3.04    2       23.5        0.4
  423   2   1  -8 42.049  84.097   0.374    3.03    4        4.2        0.0
  424   6   1   5 42.058  84.117   0.374    3.03    4       34.5        1.6
  425   9   0  -6 42.08   84.159   0.375    3.03    2        3.0        0.0
  426   6   4  -1 42.099  84.198   0.375    3.03    4       36.9        1.8
  427  10   1  -4 42.137  84.274   0.375    3.03    4        5.2        0.0
  428   8   3   0 42.183  84.365   0.375    3.02    4       26.1        0.9
  429   4   1  -8 42.256  84.513   0.376    3.02    4       40.4        2.1
  430   1   3   6 42.272  84.544   0.376    3.01    4        0.1        0.0
  431   6   4  -2 42.285  84.571   0.376    3.01    4       98.8       12.7
  432   1   2   7 42.393  84.786   0.377    3.0     4       26.8        0.9
  433   5   3   4 42.502  85.004   0.378    2.99    4       12.8        0.2
  434   7   3   2 42.524  85.048   0.378    2.99    4       35.2        1.6
  435  10   1   0 42.553  85.105   0.378    2.99    4        0.0        0.0
  436   6   2  -7 42.588  85.175   0.378    2.99    4       11.1        0.2
  437   9   1   2 42.59   85.18    0.378    2.99    4       55.0        3.9
  438   7   3  -5 42.595  85.191   0.378    2.99    4       75.8        7.4
  439   1   1  -8 42.701  85.403   0.379    2.98    4        0.5        0.0
  440   2   4   4 42.712  85.424   0.379    2.98    4       72.4        6.8
  441   6   4   0 42.742  85.483   0.379    2.97    4       26.1        0.9
  442   5   0   6 42.755  85.51    0.379    2.97    2        8.1        0.0
  443   0   0   8 42.77   85.54    0.38     2.97    2       30.6        0.6
  444   9   2   1 43.026  86.053   0.381    2.95    4        2.9        0.0
  445   5   4  -4 43.075  86.15    0.382    2.95    4       48.9        3.0
  446   5   1  -8 43.116  86.233   0.382    2.95    4        0.8        0.0
  447   9   1  -6 43.168  86.336   0.382    2.94    4       25.6        0.8
  448   8   3  -4 43.176  86.352   0.382    2.94    4       14.3        0.3
  449   8   2  -6 43.203  86.407   0.383    2.94    4       61.1        4.7
  450   2   4  -5 43.27   86.541   0.383    2.93    4       15.6        0.3
  451   6   4  -3 43.3    86.6     0.383    2.93    4        2.4        0.0
  452   5   4   2 43.386  86.772   0.384    2.93    4       22.7        0.6
  453   6   0  -8 43.392  86.784   0.384    2.93    2      115.2        8.4
  454   1   4  -5 43.394  86.789   0.384    2.92    4        9.2        0.1
  455   9   2  -5 43.459  86.919   0.385    2.92    4        3.9        0.0
  456   4   4   3 43.54   87.081   0.385    2.91    4        4.4        0.0
  457   3   1   7 43.609  87.218   0.386    2.91    4       40.6        2.1
  458   3   4  -5 43.65   87.299   0.386    2.91    4        8.1        0.1
  459   6   3  -6 43.698  87.396   0.386    2.9     4        2.3        0.0
  460   1   5   0 43.71   87.421   0.386    2.9     4       46.0        2.7
  461   4   2   6 43.78   87.561   0.387    2.9     4      126.2       20.0
  462   5   1   6 43.841  87.682   0.387    2.89    4        8.1        0.1
  463   0   1   8 43.856  87.712   0.387    2.89    4        2.6        0.0
  464   0   5   1 43.872  87.744   0.387    2.89    4       14.8        0.3
  465   8   1  -7 43.914  87.828   0.388    2.89    4       44.4        2.5
  466   1   5  -1 43.948  87.896   0.388    2.89    4        8.1        0.1
  467  10   2  -2 43.95   87.9     0.388    2.89    4       87.7        9.6
  468   4   3   5 43.959  87.919   0.388    2.89    4        3.8        0.0
  469   8   3   1 44.003  88.007   0.388    2.88    4        1.6        0.0
  470   0   4   5 44.021  88.042   0.388    2.88    4       48.1        2.9
  471   2   3   6 44.082  88.165   0.389    2.88    4       19.5        0.5
  472  10   1  -5 44.103  88.205   0.389    2.88    4       11.8        0.2
  473   6   4   1 44.209  88.419   0.39     2.87    4        5.3        0.0
  474  10   2  -3 44.26   88.52    0.39     2.87    4        8.5        0.1
  475   1   5   1 44.299  88.598   0.39     2.87    4       27.5        0.9
  476   2   2   7 44.378  88.757   0.391    2.86    4        9.9        0.1
  477   1   0   8 44.427  88.854   0.391    2.86    2       13.4        0.1
  478   2   5   0 44.464  88.929   0.392    2.86    4       42.0        2.2
  479  10   2  -1 44.467  88.933   0.392    2.86    4       10.1        0.1
  480   6   1  -8 44.477  88.954   0.392    2.86    4       10.3        0.1
  481   7   2   4 44.516  89.032   0.392    2.85    4       10.8        0.1
  482   2   5  -1 44.526  89.053   0.392    2.85    4        6.3        0.0
  483   4   4  -5 44.531  89.062   0.392    2.85    4        2.6        0.0
  484  11   0  -2 44.537  89.075   0.392    2.85    2       51.4        1.6
  485   7   2  -7 44.628  89.255   0.393    2.85    4       25.9        0.8
  486   8   0   4 44.648  89.297   0.393    2.85    2        5.1        0.0
  487   3   4   4 44.672  89.345   0.393    2.85    4       39.3        1.9
  488   8   2   3 44.692  89.384   0.393    2.84    4       20.8        0.5
  489  10   1   1 44.723  89.446   0.393    2.84    4       40.6        2.0
  490   2   3  -7 44.887  89.774   0.394    2.83    4       18.5        0.4
  491   3   3  -7 44.915  89.829   0.395    2.83    4       58.7        4.2
  492   9   3  -2 44.95   89.901   0.395    2.83    4        6.6        0.1


  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   2   0   0   7.61   15.22   6.75444       33.3      4.6      4.7     5.6
    2   1   1   0   8.782  17.564  5.8587        14.1      2.0      2.0     5.6
    3   0   1   1   9.302  18.605  5.53343       54.8      7.6      7.6     5.6
    4   1   0  -2   9.472  18.943  5.43556       92.5     12.9     12.9     5.6
    5   1   1  -1   9.537  19.074  5.39858       19.9      2.8      2.8     5.6
    6   0   0   2   9.774  19.548  5.26885       38.9      5.4      5.4     5.6
    7   1   1   1  10.558  21.117  4.88141      717.3    100.0    100.0     5.6
    8   2   0  -2  10.642  21.285  4.84331      387.8     54.1     54.1     5.6
    9   1   0   2  11.438  22.877  4.5103        70.1      9.8      9.8     5.6
   10   2   1   1  12.893  25.787  4.00853       89.6     12.5     12.4     5.6
   11   3   1  -1  13.738  27.476  3.76638      437.5     61.0     60.7     5.6
   12   2   0   2  14.01   28.02   3.69479      127.7     17.8     17.7     5.6
   13   4   0   0  15.358  30.716  3.37722       43.3      6.0      6.0     5.6
   14   3   1   1  15.87   31.739  3.27103       27.8      3.9      3.8     5.6
   15   0   2   0  15.97   31.94   3.251        166.1     23.2     23.0     5.6
   16   1   1  -3  16.32   32.641  3.18303      104.2     14.5     14.4     5.6
   17   2   1  -3  16.737  33.474  3.10601       61.5      8.6      8.5     5.7
   18   0   1   3  16.824  33.648  3.09043       16.0      2.2      2.2     5.7
   19   1   2  -1  16.871  33.742  3.08205       10.0      1.4      1.4     5.7
   20   3   0   2  17.12   34.239  3.03859       34.2      4.8      4.7     5.7
   21   4   1   0  17.364  34.729  2.99705       44.1      6.1      6.1     5.7
   22   4   1  -2  17.794  35.588  2.92691       34.2      4.8      4.7     5.7
   23   3   1  -3  18.017  36.034  2.89192        8.7      1.2      1.2     5.7
   24   1   2  -2  18.699  37.397  2.79005       45.6      6.4      6.3     5.7
   25   3   1   2  18.961  37.922  2.75282       28.7      4.0      3.9     5.7
   26   2   2   1  19.053  38.106  2.74002        8.0      1.1      1.1     5.7
   27   1   0  -4  19.132  38.263  2.72918       46.0      6.4      6.3     5.7
   28   5   0  -2  19.167  38.334  2.7243        21.6      3.0      3.0     5.7
   29   4   1   1  19.234  38.469  2.71516       80.8     11.3     11.1     5.7
   30   2   2  -2  19.352  38.704  2.69929        9.4      1.3      1.3     5.7
   31   1   2   2  19.826  39.651  2.6373       116.2     16.2     15.9     5.7
   32   4   1  -3  20.017  40.033  2.61313       54.6      7.6      7.5     5.7
   33   3   0  -4  20.09   40.18   2.60402       13.0      1.8      1.8     5.7
   34   4   0   2  20.572  41.143  2.54559       12.6      1.8      1.7     5.7
   35   3   2  -2  20.757  41.514  2.52386       12.1      1.7      1.7     5.7
   36   5   1  -2  20.854  41.707  2.51266       13.1      1.8      1.8     5.7
   37   5   1   0  21.009  42.017  2.49495       15.3      2.1      2.1     5.7
   38   3   2   1  21.266  42.532  2.46614       28.3      3.9      3.9     5.7
   39   1   0   4  21.297  42.594  2.46273       45.9      6.4      6.3     5.7
   40   4   0  -4  21.676  43.352  2.42166       20.3      2.8      2.8     5.7
   41   3   1  -4  21.717  43.433  2.41736       22.5      3.1      3.1     5.7
   42   0   2   3  22.018  44.035  2.38592       39.0      5.4      5.3     5.7
   43   4   2   0  22.451  44.902  2.34215       13.6      1.9      1.9     5.7
   44   5   1  -3  22.58   45.16   2.32948        7.9      1.1      1.1     5.7
   45   6   0  -2  22.778  45.557  2.31026       51.8      7.2      7.1     5.7
   46   5   1   1  22.87   45.74   2.30148       35.8      5.0      4.9     5.7
   47   3   2  -3  22.981  45.963  2.29094        8.1      1.1      1.1     5.7
   48   2   0   4  23.368  46.735  2.25515        9.5      1.3      1.3     5.7
   49   6   0   0  23.408  46.816  2.25148        7.3      1.0      1.0     5.7
   50   5   0  -4  23.861  47.722  2.21119        8.3      1.2      1.1     5.7
   51   6   1  -2  24.26   48.52   2.17693       26.1      3.6      3.5     5.7
   52   1   3  -1  25.018  50.036  2.11504       11.9      1.7      1.6     5.7
   53   1   3   1  25.473  50.946  2.07973       27.5      3.8      3.7     5.8
   54   1   1  -5  25.704  51.409  2.06226       25.4      3.5      3.4     5.8
   55   0   2   4  25.913  51.827  2.04677       11.2      1.6      1.5     5.8
   56   3   1  -5  26.029  52.058  2.0383        20.2      2.8      2.7     5.8
   57   1   3  -2  26.378  52.757  2.0132        26.8      3.7      3.6     5.8
   58   4   2   2  26.505  53.01   2.00427       62.1      8.7      8.4     5.8
   59   6   0  -4  26.537  53.074  2.00203       19.1      2.7      2.6     5.8
   60   2   3  -2  26.881  53.762  1.97829        7.4      1.0      1.0     5.8
   61   3   3  -1  27.119  54.239  1.96219      105.2     14.7     14.2     5.8
   62   4   2  -4  27.424  54.848  1.94207       14.7      2.1      2.0     5.8
   63   1   1   5  27.885  55.77   1.91246       38.7      5.4      5.2     5.8
   64   7   1  -1  27.939  55.877  1.9091        27.7      3.9      3.7     5.8
   65   6   0   2  28.206  56.413  1.89244        7.9      1.1      1.1     5.8
   66   6   2  -2  28.357  56.715  1.88319       28.9      4.0      3.9     5.8
   67   3   3   1  28.397  56.794  1.8808        36.3      5.1      4.9     5.8
   68   1   3  -3  28.683  57.366  1.86361       11.7      1.6      1.6     5.8
   69   5   1  -5  28.8    57.6    1.85666       22.1      3.1      3.0     5.8
   70   2   2   4  28.863  57.726  1.85298       44.0      6.1      5.9     5.8
   71   6   2   0  28.898  57.795  1.85094       27.3      3.8      3.7     5.8
   72   7   1  -3  28.949  57.897  1.84796       38.4      5.4      5.2     5.8
   73   5   1   3  29.288  58.575  1.82844       22.1      3.1      3.0     5.8
   74   2   0  -6  29.345  58.69   1.82518       17.3      2.4      2.3     5.8
   75   3   0  -6  29.582  59.164  1.81185       20.4      2.8      2.7     5.8
   76   3   3  -3  29.805  59.61   1.79953       23.9      3.3      3.2     5.8
   77   1   3   3  29.916  59.833  1.79345       11.8      1.6      1.6     5.8
   78   4   0  -6  30.397  60.794  1.76774       10.4      1.4      1.4     5.8
   79   4   3   1  30.652  61.305  1.75444       10.2      1.4      1.4     5.8
   80   7   1   1  30.813  61.626  1.74618       28.7      4.0      3.8     5.8
   81   6   2  -4  31.648  63.296  1.70472       30.8      4.3      4.1     5.9
   82   8   0   0  31.985  63.971  1.68861       15.2      2.1      2.0     5.9
   83   3   1   5  32.231  64.462  1.67712       29.5      4.1      3.9     5.9
   84   7   2   0  32.616  65.231  1.65948       12.9      1.8      1.7     5.9
   85   8   0  -4  33.077  66.155  1.6389         7.2      1.0      1.0     5.9
   86   5   3  -3  33.138  66.276  1.63624       11.6      1.6      1.5     5.9
   87   5   3   1  33.363  66.727  1.62645       34.1      4.8      4.5     5.9
   88   7   1  -5  33.627  67.255  1.61516       19.0      2.7      2.5     5.9
   89   2   2  -6  34.195  68.391  1.59152       15.4      2.2      2.0     5.9
   90   7   2  -4  34.453  68.906  1.58107       10.4      1.4      1.4     5.9
   91   4   2  -6  35.167  70.333  1.553         14.3      2.0      1.9     5.9
   92   0   2   6  35.37   70.741  1.54521       34.3      4.8      4.5     5.9
   93   2   4  -2  35.481  70.962  1.54103       13.5      1.9      1.8     5.9
   94   1   3  -5  35.639  71.279  1.53508       10.0      1.4      1.3     5.9
   95   1   4   2  35.797  71.594  1.52922       16.7      2.3      2.2     5.9
   96   3   1  -7  36.098  72.195  1.51819       23.3      3.3      3.1     5.9
   97   6   3   1  36.495  72.99   1.50392        7.5      1.0      1.0     6.0
   98   9   1  -3  36.643  73.285  1.4987        41.9      5.8      5.5     6.0
   99   2   4   2  36.953  73.907  1.48788        8.1      1.1      1.1     6.0
  100   4   4   0  37.639  75.279  1.46467       17.3      2.4      2.3     6.0
  101   8   2  -4  37.676  75.352  1.46345       11.1      1.5      1.4     6.0
  102   5   3   3  38.687  77.374  1.43099        9.5      1.3      1.2     6.0
  103   1   1   7  39.102  78.204  1.41819       13.5      1.9      1.7     6.0
  104   4   0   6  39.408  78.816  1.40895        9.2      1.3      1.2     6.0
  105   7   3   1  40.036  80.071  1.39051        7.9      1.1      1.0     6.0
  106   9   1  -5  40.185  80.369  1.38621       11.2      1.6      1.4     6.0
  107   4   4   2  40.76   81.519  1.37001        7.7      1.1      1.0     6.1
  108   8   2   2  41.213  82.427  1.35758       13.7      1.9      1.8     6.1
  109   3   3   5  41.314  82.627  1.35487       10.2      1.4      1.3     6.1
  110   4   4  -4  41.509  83.018  1.34965       13.0      1.8      1.7     6.1
  111   6   4  -2  42.285  84.571  1.32941       14.8      2.1      1.9     6.1
  112   7   3  -5  42.595  85.191  1.32157       11.3      1.6      1.4     6.1
  113   2   4   4  42.712  85.424  1.31865        7.6      1.1      1.0     6.1
  114   6   0  -8  43.392  86.784  1.30201        8.5      1.2      1.1     6.1
  115   4   2   6  43.78   87.561  1.29276       20.0      2.8      2.5     6.2
  116  10   2  -2  43.95   87.9    1.28879        9.6      1.3      1.2     6.2

Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)