Institute of Experimental Mineralogy
                 Russian Academy of Sciences
     -------------------------------------------------
           142432, Chernogolovka, Moscow district
             A.V. Chichagov  +7(496)52-22320

                            ***

          ***      W W W - X R A Y P O L       ***
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THERASIAITE

1, DF

[NH(4)](3)KNa(2)Fe''Fe'''[SO(4)](3)Cl(5)


Monoclinic  C c  Z = 4

Cc

5 .6 .15

Ref.Str.:

         Demartin F., Castellano C., Campostrini I. (2014)

         * Mineral. Mag., 78, 203-213

         L: $Fe2+1 Fe3+1 S3 O12 Cl5 Na2 N2.254 H3 K1.746$

         R: Locality - La Fossa Crater, Vulcano, Aeolian islands, Italy.

         See U(ij) in the original.  N.A.D.

                   Initial data from BDM-file 

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

             a =  18.284    alpha =   90.0 
             b =  12.073    beta  =  108.1 
             c =   9.535    gamma =   90.0 

    Unit cell volume (cub. angs.) =  2000.63

    Molar volume ( cub.cm/mol.) =   301.26

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

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

   1 0.6171  0.2464  0.3069   0.0    Fe    = 1.00
   2 0.7883  0.1605  0.1341   0.0    Fe    = 1.00
   3 0.4752  0.0775  0.314    0.0    S     = 1.00
   4 0.7629  0.4055  0.2857   0.0    S     = 1.00
   5 0.7732  0.0999  0.4688   0.0    S     = 1.00
   6 0.5371  0.1328  0.2652   0.0    O     = 1.00
   7 0.4079  0.148   0.2522   0.0    O     = 0.7 , O     = 0.0 
   8 0.4931  0.076   0.4714   0.0    O     = 0.7 , O     = 0.0 
   9 0.4662  0.9654  0.2548   0.0    O     = 0.7 , O     = 0.0 
  10 0.4038  0.079   0.1987   0.0    O     = 0.3 , O     = 0.0 
  11 0.4691  0.1313  0.441    0.0    O     = 0.3 , O     = 0.0 
  12 0.5021  0.9674  0.328    0.0    O     = 0.3 , O     = 0.0 
  13 0.7065  0.3489  0.3467   0.0    O     = 1.00
  14 0.8039  0.3215  0.2249   0.0    O     = 1.00
  15 0.8179  0.4604  0.411    0.0    O     = 1.00
  16 0.7217  0.4824  0.1702   0.0    O     = 1.00
  17 0.6893  0.1269  0.4232   0.0    O     = 1.00
  18 0.7958  0.0777  0.336    0.0    O     = 1.00
  19 0.8184  0.189   0.5545   0.0    O     = 1.00
  20 0.7838  0.9991  0.5568   0.0    O     = 1.00
  21 0.9329  0.1613  0.1939   0.0    Cl    = 1.00
  22 0.6427  0.1779  0.0804   0.0    Cl    = 1.00
  23 0.597   0.3162  0.52     0.0    Cl    = 1.00
  24 0.7661  0.243   0.8829   0.0    Cl    = 1.00
  25 0.5354  0.3819  0.1546   0.0    Cl    = 1.00
  26 0.7767  0.3549  0.6249   0.0    Na    = 1.00
  27 0.8834  0.3862  0.0536   0.0    Na    = 1.00
  28 0.6218  0.417   0.8767   0.0    NH(4) = 0.74, K     = 0.26
  29 0.6258  0.0736  0.7045   0.0    NH(4) = 0.84, K     = 0.16
  30 0.9105  0.9039  0.344    0.0    NH(4) = 0.68, K     = 0.32
  31 0.9441  0.3151  0.468    0.0    K     = 1.00


  Co-ordinates for all atomic positions :

   No       NoP      x/a        y/b       z/c 

     1       1     0.6171     0.2464     0.3069
     2       2     0.7883     0.1605     0.1341
     3       3     0.4752     0.0775     0.314 
     4       4     0.7629     0.4055     0.2857
     5       5     0.7732     0.0999     0.4688
     6       6     0.5371     0.1328     0.2652
     7       7     0.4079     0.148      0.2522
     8       8     0.4931     0.076      0.4714
     9       9     0.4662     0.9654     0.2548
    10      10     0.4038     0.079      0.1987
    11      11     0.4691     0.1313     0.441 
    12      12     0.5021     0.9674     0.328 
    13      13     0.7065     0.3489     0.3467
    14      14     0.8039     0.3215     0.2249
    15      15     0.8179     0.4604     0.411 
    16      16     0.7217     0.4824     0.1702
    17      17     0.6893     0.1269     0.4232
    18      18     0.7958     0.0777     0.336 
    19      19     0.8184     0.189      0.5545
    20      20     0.7838     0.9991     0.5568
    21      21     0.9329     0.1613     0.1939
    22      22     0.6427     0.1779     0.0804
    23      23     0.597      0.3162     0.52  
    24      24     0.7661     0.243      0.8829
    25      25     0.5354     0.3819     0.1546
    26      26     0.7767     0.3549     0.6249
    27      27     0.8834     0.3862     0.0536
    28      28     0.6218     0.417      0.8767
    29      29     0.6258     0.0736     0.7045
    30      30     0.9105     0.9039     0.344 
    31      31     0.9441     0.3151     0.468 
    32       1     0.6171     0.7536     0.8069
    33       2     0.7883     0.8395     0.6341
    34       3     0.4752     0.9225     0.814 
    35       4     0.7629     0.5945     0.7857
    36       5     0.7732     0.9001     0.9688
    37       6     0.5371     0.8672     0.7652
    38       7     0.4079     0.852      0.7522
    39       8     0.4931     0.924      0.9714
    40       9     0.4662     0.0346     0.7548
    41      10     0.4038     0.921      0.6987
    42      11     0.4691     0.8687     0.941 
    43      12     0.5021     0.0326     0.828 
    44      13     0.7065     0.6511     0.8467
    45      14     0.8039     0.6785     0.7249
    46      15     0.8179     0.5396     0.911 
    47      16     0.7217     0.5176     0.6702
    48      17     0.6893     0.8731     0.9232
    49      18     0.7958     0.9223     0.836 
    50      19     0.8184     0.811      0.0545
    51      20     0.7838     0.0009     0.0568
    52      21     0.9329     0.8387     0.6939
    53      22     0.6427     0.8221     0.5804
    54      23     0.597      0.6838     0.02  
    55      24     0.7661     0.757      0.3829
    56      25     0.5354     0.6181     0.6546
    57      26     0.7767     0.6451     0.1249
    58      27     0.8834     0.6138     0.5536
    59      28     0.6218     0.583      0.3767
    60      29     0.6258     0.9264     0.2045
    61      30     0.9105     0.0961     0.844 
    62      31     0.9441     0.6849     0.968 
    63       1     0.1171     0.2536     0.8069
    64       2     0.2883     0.3395     0.6341
    65       3     0.9752     0.4225     0.814 
    66       4     0.2629     0.0945     0.7857
    67       5     0.2732     0.4001     0.9688
    68       6     0.0371     0.3672     0.7652
    69       7     0.9079     0.352      0.7522
    70       8     0.9931     0.424      0.9714
    71       9     0.9662     0.5346     0.7548
    72      10     0.9038     0.421      0.6987
    73      11     0.9691     0.3687     0.941 
    74      12     0.0021     0.5326     0.828 
    75      13     0.2065     0.1511     0.8467
    76      14     0.3039     0.1785     0.7249
    77      15     0.3179     0.0396     0.911 
    78      16     0.2217     0.0176     0.6702
    79      17     0.1893     0.3731     0.9232
    80      18     0.2958     0.4223     0.836 
    81      19     0.3184     0.311      0.0545
    82      20     0.2838     0.5009     0.0568
    83      21     0.4329     0.3387     0.6939
    84      22     0.1427     0.3221     0.5804
    85      23     0.097      0.1838     0.02  
    86      24     0.2661     0.257      0.3829
    87      25     0.0354     0.1181     0.6546
    88      26     0.2767     0.1451     0.1249
    89      27     0.3834     0.1138     0.5536
    90      28     0.1218     0.083      0.3767
    91      29     0.1258     0.4264     0.2045
    92      30     0.4105     0.5961     0.844 
    93      31     0.4441     0.1849     0.968 
    94       1     0.1171     0.7464     0.3069
    95       2     0.2883     0.6605     0.1341
    96       3     0.9752     0.5775     0.314 
    97       4     0.2629     0.9055     0.2857
    98       5     0.2732     0.5999     0.4688
    99       6     0.0371     0.6328     0.2652
   100       7     0.9079     0.648      0.2522
   101       8     0.9931     0.576      0.4714
   102       9     0.9662     0.4654     0.2548
   103      10     0.9038     0.579      0.1987
   104      11     0.9691     0.6313     0.441 
   105      12     0.0021     0.4674     0.328 
   106      13     0.2065     0.8489     0.3467
   107      14     0.3039     0.8215     0.2249
   108      15     0.3179     0.9604     0.411 
   109      16     0.2217     0.9824     0.1702
   110      17     0.1893     0.6269     0.4232
   111      18     0.2958     0.5777     0.336 
   112      19     0.3184     0.689      0.5545
   113      20     0.2838     0.4991     0.5568
   114      21     0.4329     0.6613     0.1939
   115      22     0.1427     0.6779     0.0804
   116      23     0.097      0.8162     0.52  
   117      24     0.2661     0.743      0.8829
   118      25     0.0354     0.8819     0.1546
   119      26     0.2767     0.8549     0.6249
   120      27     0.3834     0.8862     0.0536
   121      28     0.1218     0.917      0.8767
   122      29     0.1258     0.5736     0.7045
   123      30     0.4105     0.4039     0.344 
   124      31     0.4441     0.8151     0.468 


X-ray density (g/cm cub.)   =      2.43

MU (1/cm) =     226.425    Mass attenuation coefficient (cm**2/g) =     93.195

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

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

    1    Fe                  3.132        6
                                                 1.9546       6
                                                 1.9902      13
                                                 2.0357      17
                                                 2.4889      22
                                                 2.3315      23
                                                 2.3809      25
    2    Fe                  3.132        6
                                                 2.1104      14
                                                 2.1357      18
                                                 2.5258      21
                                                 2.5591      22
                                                 2.5079      24
                                                 2.056       20
    3    S                   2.52         7
                                                 1.5056       6
                                                 1.4619       7
                                                 1.4338       8
                                                 1.4553       9
                                                 1.422       10
                                                 1.4095      11
                                                 1.4085      12
    4    S                   2.52         4
                                                 1.4979      13
                                                 1.4818      14
                                                 1.4595      15
                                                 1.4585      16
    5    S                   2.52         4
                                                 1.4956      17
                                                 1.4728      18
                                                 1.4447      19
                                                 1.4565      20
    6    O                   3.804       11
                                                 2.3331       7
                                                 2.442        8
                                                 2.3859       9
                                                 2.4083      10
                                                 2.3765      11
                                                 2.2343      12
                                                 2.7233      17
                                                 3.0408      22
                                                 3.2176      23
                                                 3.1841      25
                                                 3.6673       8
    7   O    ,O              3.804       10
                                                 2.3331       6
                                                 2.3511       8
                                                 2.4455       9
                                                 0.9675      10
                                                 1.8116      11
                                                 2.733       12
                                                 3.4175      15
                                                 2.8616      19
                                                 3.4661      24
                                                 3.4177      15
    8   O    ,O              3.804       12
                                                 2.442        6
                                                 2.3511       7
                                                 2.3789       9
                                                 2.6058      10
                                                 0.8021      11
                                                 1.9379      12
                                                 3.419       23
                                                 3.6673       6
                                                 2.9359       9
                                                 3.6144      10
                                                 3.3934      12
                                                 3.3761      15
    9   O    ,O              3.804       12
                                                 2.3859       6
                                                 2.4455       7
                                                 2.3789       8
                                                 1.7577      10
                                                 2.6661      11
                                                 0.7962      12
                                                 2.9359       8
                                                 3.2275      11
                                                 3.6578      15
                                                 3.3729      14
                                                 3.4766      15
                                                 3.7377      21
   10   O    ,O              3.804       12
                                                 2.4083       6
                                                 0.9675       7
                                                 2.6058       8
                                                 1.7577       9
                                                 2.3341      11
                                                 2.2779      12
                                                 3.6144       8
                                                 2.7463      15
                                                 3.2926      19
                                                 3.6531      14
                                                 3.2546      15
                                                 3.4578      16
   11   O    ,O              3.804       11
                                                 2.3765       6
                                                 1.8116       7
                                                 0.8021       8
                                                 2.6661       9
                                                 2.3341      10
                                                 2.4175      12
                                                 3.1509      23
                                                 3.2275       9
                                                 3.7439      12
                                                 3.6764      21
                                                 3.3902      15
   12   O    ,O              3.804       11
                                                 2.2343       6
                                                 2.733        7
                                                 1.9379       8
                                                 0.7962       9
                                                 2.2779      10
                                                 2.4175      11
                                                 3.7835      17
                                                 3.3934       8
                                                 3.7439      11
                                                 3.4109      22
                                                 3.6928      15
   13    O                   3.804       10
                                                 2.4327      14
                                                 2.3578      15
                                                 2.408       16
                                                 2.8209      17
                                                 3.6741      18
                                                 3.0526      19
                                                 3.1981      22
                                                 2.991       23
                                                 3.1208      25
                                                 3.6341      16
   14    O                   3.804       10
                                                 2.4327      13
                                                 2.3968      15
                                                 2.4121      16
                                                 3.1474      18
                                                 3.4627      19
                                                 3.1345      21
                                                 3.3273      22
                                                 3.2568      24
                                                 3.3729       9
                                                 3.6531      10
   15    O                   3.804       15
                                                 2.3578      13
                                                 2.3968      14
                                                 2.4342      16
                                                 3.5498      19
                                                 3.518       16
                                                 3.6917      24
                                                 3.4175       7
                                                 3.6578       9
                                                 2.7463      10
                                                 3.4177       7
                                                 3.3761       8
                                                 3.4766       9
                                                 3.2546      10
                                                 3.3902      11
                                                 3.6928      12
   16    O                   3.804        8
                                                 2.408       13
                                                 2.4121      14
                                                 2.4342      15
                                                 3.5754      25
                                                 3.6341      13
                                                 3.518       15
                                                 3.3362      23
                                                 3.4578      10
   17    O                   3.804        8
                                                 2.7233       6
                                                 3.7835      12
                                                 2.8209      13
                                                 2.4168      18
                                                 2.4215      19
                                                 2.3711      20
                                                 3.1716      22
                                                 3.1445      23
   18    O                   3.804        8
                                                 3.6741      13
                                                 3.1474      14
                                                 2.4168      17
                                                 2.4046      19
                                                 2.3806      20
                                                 3.3545      21
                                                 3.3167      22
                                                 2.7627      20
   19    O                   3.804        9
                                                 3.0526      13
                                                 3.4627      14
                                                 3.5498      15
                                                 2.4215      17
                                                 2.4046      18
                                                 2.3801      20
                                                 3.6061      24
                                                 2.8616       7
                                                 3.2926      10
   20    O                   3.804        7
                                                 2.3711      17
                                                 2.3806      18
                                                 2.3801      19
                                                 2.7627      18
                                                 3.2675      21
                                                 3.4114      22
                                                 3.3267      24
   21    Cl                  4.344       11
                                                 3.1345      14
                                                 3.3545      18
                                                 3.6676      24
                                                 3.2675      20
                                                 4.1502       8
                                                 3.6764      11
                                                 3.8626      23
                                                 4.2383      25
                                                 3.7377       9
                                                 3.9863      12
                                                 3.9322      25
   22    Cl                  4.344       13
                                                 3.0408       6
                                                 3.1981      13
                                                 3.3273      14
                                                 3.9451      16
                                                 3.1716      17
                                                 3.3167      18
                                                 3.4491      24
                                                 3.3577      25
                                                 4.0241       8
                                                 4.1013       9
                                                 3.4109      12
                                                 4.1607      17
                                                 3.4114      20
   23    Cl                  4.344       12
                                                 3.2176       6
                                                 4.1372       7
                                                 3.419        8
                                                 3.1509      11
                                                 2.991       13
                                                 3.1445      17
                                                 4.2446      19
                                                 3.9579      24
                                                 3.4056      25
                                                 3.3362      16
                                                 4.1349      25
                                                 3.8626      21
   24    Cl                  4.344       13
                                                 3.2568      14
                                                 4.2301      16
                                                 3.6061      19
                                                 3.6676      21
                                                 3.4491      22
                                                 3.9579      23
                                                 3.6917      15
                                                 3.8388      16
                                                 3.9549      18
                                                 3.3267      20
                                                 3.4661       7
                                                 4.0973      10
                                                 3.8868      11
   25    Cl                  4.344       10
                                                 3.1841       6
                                                 3.9527       7
                                                 3.1208      13
                                                 3.5754      16
                                                 3.3577      22
                                                 3.4056      23
                                                 4.1349      23
                                                 3.8779      19
                                                 4.2383      21
                                                 3.9322      21
   26    Na                  3.348        8
                                                 2.5638      13
                                                 2.7023      15
                                                 2.3152      19
                                                 3.1571      23
                                                 2.8653      24
                                                 2.3077      16
                                                 2.3282       7
                                                 2.3489      10
   27    Na                  3.348       10
                                                 2.6199      14
                                                 3.0389      21
                                                 2.8402      24
                                                 2.3873      15
                                                 3.071        7
                                                 2.4132       8
                                                 2.1678      11
                                                 2.2543       9
                                                 2.6737      10
                                                 2.9982      12
   28   NH(4),K              3.768       10
                                                 2.9352      16
                                                 3.4333      22
                                                 3.5066      23
                                                 3.3581      24
                                                 3.5068      25
                                                 3.2775      13
                                                 3.305       16
                                                 3.582       23
                                                 3.2858      25
                                                 3.4811      21
   29   NH(4),K              3.768       13
                                                 2.7341       8
                                                 3.2452      11
                                                 3.3003      17
                                                 3.6972      20
                                                 3.7203      22
                                                 3.3729      23
                                                 3.3091      24
                                                 3.124        6
                                                 3.1358       9
                                                 2.8981      12
                                                 3.1705      17
                                                 3.4855      18
                                                 3.3084      22
   30   NH(4),K              3.768       11
                                                 2.9519      18
                                                 3.7055      20
                                                 3.4976      21
                                                 2.9712      19
                                                 3.2091      20
                                                 3.3271      21
                                                 3.2969      24
                                                 3.2073       7
                                                 3.4954      11
                                                 3.4651      23
                                                 3.3324      25
   31    K                   3.768       13
                                                 2.8735      14
                                                 2.8146      15
                                                 3.0759      19
                                                 3.1605      21
                                                 2.8847       6
                                                 3.0157       7
                                                 3.7389       9
                                                 2.8328      10
                                                 3.4525      22
                                                 3.1243      25
                                                 3.2725       8
                                                 2.8461       9
                                                 2.6773      12

  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   1   0  5.176  10.351   0.05   242.79    4       68.9      115.1
    2   2   0   0  5.908  11.816   0.058  185.79    2      158.4      233.0
    3   1   1  -1  6.969  13.938   0.068  132.89    4      189.6      477.4
    4   1   1   1  8.339  16.678   0.081   92.14    4      220.0      445.7
    5   0   2   0  8.521  17.042   0.083   88.15    2      145.1       92.7
    6   3   1   0  9.861  19.722   0.096   65.27    4      125.9      103.3
    7   3   1  -1  9.907  19.814   0.096   64.65    4       96.2       59.8
    8   0   2   1 10.255  20.51    0.1     60.19    4       96.8       56.3
    9   2   2   0 10.394  20.788   0.101   58.53    4      102.5       61.4
   10   2   2  -1 10.934  21.868   0.106   52.69    4       62.9       20.8
   11   2   0  -2 11.08   22.16    0.107   51.26    2      103.5       27.5
   12   0   0   2 11.384  22.768   0.11    48.44    2       89.6       19.4
   13   1   1  -2 11.651  23.303   0.113   46.15    4      150.2      104.1
   14   4   0   0 11.88   23.761   0.115   44.31    2      148.0       48.5
   15   3   1   1 12.727  25.455   0.123   38.34    4       24.6        2.3
   16   2   2   1 12.736  25.472   0.123   38.29    4       20.1        1.6
   17   3   1  -2 12.836  25.671   0.124   37.66    4       75.2       21.3
   18   1   3   0 13.188  26.376   0.128   35.57    4       77.3       21.2
   19   1   1   2 13.362  26.724   0.129   34.6     4       60.2       12.5
   20   4   0  -2 13.7    27.4     0.132   32.81    2       90.1       13.3
   21   1   3  -1 14.013  28.026   0.135   31.28    4       64.0       12.8
   22   2   2  -2 14.044  28.088   0.136   31.13    4       40.4        5.1
   23   0   2   2 14.289  28.578   0.138   30.0     4       51.8        8.0
   24   4   2  -1 14.353  28.706   0.139   29.72    4       76.7       17.5
   25   2   0   2 14.44   28.879   0.139   29.34    2       60.5        5.4
   26   4   2   0 14.694  29.387   0.142   28.27    4      139.4       54.9
   27   1   3   1 14.764  29.529   0.142   27.98    4       79.7       17.8
   28   5   1  -1 14.848  29.697   0.143   27.64    4       79.8       17.6
   29   5   1   0 15.533  31.065   0.15    25.09    4       85.0       18.1
   30   3   3   0 15.702  31.404   0.151   24.52    4       86.2       18.2
   31   3   3  -1 15.732  31.463   0.152   24.41    4      303.2      224.3
   32   4   2  -2 16.223  32.446   0.156   22.85    4      103.9       24.6
   33   5   1  -2 16.336  32.671   0.157   22.51    4      253.1      144.1
   34   2   2   2 16.862  33.723   0.162   21.01    4      130.5       35.8
   35   1   3  -2 16.92   33.839   0.163   20.85    4      146.5       44.7
   36   1   1  -3 17.087  34.174   0.164   20.41    4       98.0       19.6
   37   4   2   1 17.125  34.249   0.165   20.31    4       38.0        2.9
   38   3   1   2 17.178  34.356   0.165   20.18    4      249.7      125.7
   39   0   4   0 17.239  34.477   0.166   20.02    2      261.6       68.5
   40   3   1  -3 17.315  34.631   0.166   19.83    4       49.2        4.8
   41   3   3   1 17.701  35.403   0.17    18.9     4      448.6      380.1
   42   3   3  -2 17.782  35.564   0.171   18.71    4       87.9       14.4
   43   6   0   0 17.987  35.974   0.173   18.25    2      494.1      222.6
   44   6   0  -2 18.093  36.186   0.174   18.01    2       77.1        5.4
   45   5   1   1 18.169  36.338   0.174   17.85    4       80.1       11.5
   46   1   3   2 18.178  36.355   0.174   17.83    4       55.9        5.6
   47   0   4   1 18.201  36.402   0.175   17.78    4      302.2      162.2
   48   2   4   0 18.283  36.567   0.175   17.6     4      125.0       27.5
   49   2   2  -3 18.556  37.113   0.178   17.04    4      501.3      428.0
   50   2   4  -1 18.611  37.221   0.178   16.93    4       99.4       16.7
   51   1   1   3 18.932  37.864   0.181   16.3     4      171.2       47.7
   52   4   0   2 19.055  38.111   0.183   16.07    2      148.1       17.6
   53   6   2  -1 19.197  38.394   0.184   15.81    4      287.6      130.6
   54   5   3  -1 19.331  38.663   0.185   15.57    4      205.3       65.6
   55   0   2   3 19.335  38.669   0.185   15.56    4      107.1       17.8
   56   5   1  -3 19.555  39.11    0.187   15.18    4      298.2      134.8
   57   4   2  -3 19.744  39.489   0.189   14.85    4       26.7        1.1
   58   2   4   1 19.776  39.551   0.189   14.8     4       34.7        1.8
   59   5   3   0 19.879  39.758   0.19    14.63    4       69.8        7.1
   60   6   2   0 20.03   40.06    0.191   14.39    4      176.2       44.7
   61   6   2  -2 20.127  40.253   0.192   14.23    4      111.2       17.6
   62   7   1  -1 20.525  41.05    0.196   13.63    4      144.3       28.4
   63   5   3  -2 20.533  41.066   0.196   13.61    4      137.2       25.6
   64   2   4  -2 20.684  41.367   0.197   13.39    4       88.8       10.5
   65   0   4   2 20.859  41.718   0.199   13.14    4      133.6       23.5
   66   4   4  -1 20.905  41.81    0.199   13.08    4        8.3        0.1
   67   4   2   2 21.01   42.02    0.2     12.93    4       63.8        5.3
   68   7   1  -2 21.139  42.279   0.202   12.76    4       65.6        5.5
   69   4   4   0 21.152  42.304   0.202   12.74    4       93.8       11.2
   70   1   3  -3 21.155  42.31    0.202   12.74    4       30.9        1.2
   71   3   3   2 21.231  42.462   0.202   12.63    4      217.3       59.6
   72   3   3  -3 21.346  42.692   0.203   12.48    4      163.2       33.2
   73   7   1   0 21.581  43.161   0.206   12.18    4      189.4       43.7
   74   2   2   3 21.902  43.805   0.209   11.78    4       73.8        6.4
   75   1   5   0 21.962  43.925   0.209   11.71    4       33.8        1.3
   76   5   3   1 22.067  44.134   0.21    11.58    4      122.0       17.2
   77   2   0  -4 22.071  44.141   0.21    11.58    2      272.2       42.9
   78   5   1   2 22.156  44.313   0.211   11.48    4       82.4        7.8
   79   4   4  -2 22.294  44.589   0.212   11.32    4       48.6        2.7
   80   3   1   3 22.415  44.829   0.213   11.18    4      120.3       16.2
   81   6   2   1 22.463  44.926   0.214   11.13    4      132.2       19.4
   82   1   5  -1 22.501  45.002   0.214   11.09    4       94.5        9.9
   83   3   1  -4 22.569  45.138   0.215   11.01    4       93.3        9.6
   84   4   0  -4 22.603  45.207   0.215   10.97    2       63.1        2.2
   85   6   2  -3 22.639  45.278   0.215   10.93    4       84.8        7.9
   86   1   3   3 22.721  45.441   0.216   10.85    4      154.1       25.7
   87   2   4   2 22.787  45.574   0.217   10.77    4       74.0        5.9
   88   1   1  -4 22.895  45.79    0.217   10.66    4      112.5       13.5
   89   4   4   1 22.992  45.984   0.218   10.56    4       61.3        4.0
   90   1   5   1 23.008  46.016   0.218   10.54    4       51.7        2.8
   91   0   0   4 23.251  46.503   0.221   10.29    2       94.4        4.6
   92   5   3  -3 23.259  46.519   0.221   10.28    4       48.8        2.4
   93   7   1  -3 23.317  46.633   0.221   10.23    4      111.8       12.8
   94   8   0  -2 23.421  46.841   0.222   10.13    2      127.0        8.2
   95   3   5   0 23.661  47.322   0.224    9.89    4       31.9        1.0
   96   3   5  -1 23.682  47.365   0.225    9.87    4       43.3        1.8
   97   2   2  -4 23.823  47.646   0.226    9.74    4      291.2       82.6
   98   5   1  -4 23.922  47.845   0.227    9.65    4       22.7        0.5
   99   7   3  -1 24.108  48.217   0.228    9.48    4       34.1        1.1
  100   7   1   1 24.129  48.259   0.229    9.46    4       99.0        9.3
  101   2   4  -3 24.131  48.263   0.229    9.46    4      114.4       12.4
  102   8   0   0 24.314  48.628   0.23     9.3     2      210.5       20.6
  103   4   2  -4 24.326  48.652   0.23     9.29    4      146.2       19.8
  104   6   0   2 24.517  49.034   0.232    9.13    2       27.9        0.4
  105   1   5  -2 24.542  49.084   0.232    9.11    4       89.2        7.2
  106   7   3  -2 24.651  49.303   0.233    9.01    4       69.7        4.4
  107   6   4  -1 24.653  49.305   0.233    9.01    4      140.2       17.7
  108   6   0  -4 24.763  49.527   0.234    8.92    2      112.0        5.6
  109   0   4   3 24.766  49.531   0.234    8.92    4       33.4        1.0
  110   8   2  -1 24.803  49.605   0.234    8.89    4       59.1        3.1
  111   1   1   4 24.85   49.7     0.235    8.85    4      113.4       11.4
  112   0   2   4 24.939  49.879   0.236    8.78    4       48.3        2.0
  113   7   3   0 25.044  50.088   0.237    8.7     4      106.3        9.8
  114   8   2  -2 25.1    50.2     0.237    8.65    4       23.6        0.5
  115   4   4  -3 25.104  50.207   0.237    8.65    4       21.7        0.4
  116   3   5   1 25.124  50.249   0.237    8.63    4       98.5        8.4
  117   3   5  -2 25.185  50.37    0.238    8.58    4      132.1       15.0
  118   6   4   0 25.341  50.681   0.239    8.47    4       65.6        3.6
  119   6   4  -2 25.421  50.842   0.24     8.4     4       81.1        5.5
  120   1   5   2 25.486  50.971   0.241    8.36    4      103.3        8.9
  121   5   3   2 25.559  51.118   0.241    8.3     4      127.5       13.5
  122   3   3   3 25.791  51.582   0.243    8.13    4       95.8        7.5
  123   4   2   3 25.833  51.665   0.244    8.1     4      150.9       18.4
  124   3   3  -4 25.93   51.86    0.244    8.03    4       69.3        3.9
  125   8   2   0 25.95   51.9     0.245    8.02    4       22.6        0.4
  126   2   0   4 25.965  51.93    0.245    8.01    2       72.8        2.1
  127   6   2   2 26.144  52.287   0.246    7.88    4       93.1        6.8
  128   4   4   2 26.163  52.326   0.246    7.87    4      222.8       39.0
  129   1   3  -4 26.225  52.449   0.247    7.83    4      142.3       15.8
  130   5   5  -1 26.379  52.758   0.248    7.73    4      139.7       15.1
  131   6   2  -4 26.379  52.758   0.248    7.73    4        4.7        0.0
  132   0   6   0 26.393  52.786   0.248    7.72    2        2.2        0.0
  133   7   3  -3 26.606  53.213   0.25     7.58    4       58.6        2.6
  134   9   1  -1 26.664  53.328   0.251    7.54    4      162.7       19.9
  135   9   1  -2 26.722  53.444   0.251    7.5     4       55.1        2.3
  136   7   1  -4 26.762  53.524   0.252    7.48    4       36.7        1.0
  137   8   2  -3 26.808  53.615   0.252    7.45    4      237.2       41.9
  138   5   5   0 26.811  53.622   0.252    7.44    4       45.7        1.6
  139   2   4   3 26.923  53.845   0.253    7.37    4       51.0        1.9
  140   5   1   3 27.043  54.086   0.254    7.3     4      105.2        8.1
  141   0   6   1 27.087  54.175   0.255    7.27    4      119.2       10.3
  142   2   6   0 27.148  54.296   0.255    7.24    4       91.1        6.0
  143   5   3  -4 27.158  54.316   0.255    7.23    4       67.2        3.3
  144   5   5  -2 27.334  54.668   0.257    7.12    4      199.8       28.4
  145   7   3   1 27.347  54.694   0.257    7.12    4      143.2       14.6
  146   2   6  -1 27.389  54.778   0.257    7.09    4       91.9        6.0
  147   6   4   1 27.405  54.811   0.257    7.08    4      247.9       43.5
  148   2   2   4 27.53   55.06    0.258    7.01    4       76.0        4.0
  149   6   4  -3 27.557  55.115   0.259    6.99    4       82.0        4.7
  150   1   5  -3 27.838  55.676   0.261    6.83    4      116.7        9.3
  151   7   1   2 27.863  55.727   0.261    6.82    4       70.0        3.3
  152   3   5   2 27.9    55.8     0.262    6.8     4       79.6        4.3
  153   9   1   0 27.975  55.951   0.262    6.76    4      126.8       10.9
  154   3   5  -3 27.994  55.988   0.262    6.75    4       54.4        2.0
  155   1   3   4 28.008  56.015   0.262    6.74    4      124.2       10.4
  156   9   1  -3 28.144  56.288   0.264    6.67    4      117.9        9.3
  157   3   1   4 28.182  56.364   0.264    6.65    4       53.6        1.9
  158   2   6   1 28.265  56.53    0.265    6.6     4       52.7        1.8
  159   8   0  -4 28.274  56.547   0.265    6.6     2      345.6       39.4
  160   3   1  -5 28.35   56.7     0.265    6.56    4       53.7        1.9
  161   8   2   1 28.417  56.835   0.266    6.52    4      110.4        7.9
  162   5   5   1 28.588  57.176   0.267    6.44    4      125.1       10.1
  163   2   4  -4 28.591  57.182   0.268    6.43    4      106.7        7.3
  164   2   6  -2 28.966  57.932   0.271    6.25    4      255.2       40.6
  165   4   4  -4 29.034  58.069   0.271    6.21    4       41.7        1.1
  166   1   1  -5 29.055  58.111   0.271    6.2     4      137.4       11.7
  167   5   1  -5 29.086  58.171   0.272    6.19    4      176.2       19.2
  168   0   6   2 29.103  58.206   0.272    6.18    4      347.6       74.6
  169   1   5   3 29.132  58.265   0.272    6.17    4      127.7       10.0
  170   4   6  -1 29.139  58.278   0.272    6.16    4       40.1        1.0
  171   4   6   0 29.333  58.666   0.274    6.07    4       31.0        0.6
  172  10   0  -2 29.383  58.765   0.274    6.05    2      103.0        3.2
  173   8   4  -1 29.457  58.915   0.275    6.01    4      138.9       11.6
  174   0   4   4 29.579  59.158   0.276    5.96    4       77.2        3.5
  175   5   5  -3 29.586  59.172   0.276    5.96    4      100.6        6.0
  176   2   2  -5 29.634  59.268   0.276    5.93    4      215.4       27.5
  177   4   2  -5 29.649  59.299   0.277    5.93    4      139.9       11.6
  178   9   3  -1 29.688  59.375   0.277    5.91    4      172.4       17.6
  179   8   4  -2 29.722  59.445   0.277    5.9     4      251.4       37.2
  180   9   3  -2 29.742  59.484   0.277    5.89    4      127.0        9.5
  181   8   2  -4 29.757  59.513   0.277    5.88    4      235.8       32.7
  182   7   3  -4 29.779  59.558   0.278    5.87    4       18.4        0.2
  183   4   0   4 29.915  59.831   0.279    5.81    2      224.8       14.7
  184   5   3   3 30.041  60.083   0.28     5.76    4       51.3        1.5
  185   4   6  -2 30.244  60.488   0.282    5.67    4       33.6        0.6
  186   7   5  -1 30.308  60.616   0.282    5.64    4      179.0       18.1
  187   4   4   3 30.378  60.757   0.283    5.61    4      126.9        9.0
  188   8   4   0 30.484  60.968   0.284    5.57    4      207.9       24.1
  189   9   1   1 30.539  61.078   0.284    5.55    4      188.6       19.7
  190   8   0   2 30.591  61.182   0.284    5.53    2      207.5       11.9
  191   2   6   2 30.643  61.286   0.285    5.51    4       49.4        1.3
  192   6   4   2 30.658  61.317   0.285    5.5     4      123.9        8.4
  193   6   2   3 30.774  61.548   0.286    5.46    4      234.7       30.0
  194   7   5  -2 30.774  61.549   0.286    5.45    4       83.2        3.8
  195   9   1  -4 30.805  61.611   0.286    5.44    4       32.2        0.6
  196   7   3   2 30.81   61.62    0.286    5.44    4       99.0        5.3
  197   4   6   1 30.811  61.621   0.286    5.44    4       51.7        1.5
  198  10   2  -2 30.832  61.664   0.286    5.43    4      110.3        6.6
  199   6   4  -4 30.871  61.742   0.287    5.42    4       64.6        2.3
  200   9   3   0 30.915  61.831   0.287    5.4     4       27.8        0.4
  201  10   0   0 30.976  61.951   0.288    5.38    2       91.9        2.3
  202  10   2  -1 30.984  61.969   0.288    5.37    4       74.6        3.0
  203   0   2   5 31.013  62.025   0.288    5.36    4       43.0        1.0
  204   6   2  -5 31.056  62.113   0.288    5.35    4       91.1        4.4
  205   9   3  -3 31.074  62.148   0.289    5.34    4       92.6        4.6
  206   3   3   4 31.11   62.219   0.289    5.33    4       70.9        2.7
  207   7   5   0 31.114  62.228   0.289    5.32    4       26.9        0.4
  208   1   1   5 31.14   62.279   0.289    5.31    4      247.3       32.5
  209   7   1  -5 31.198  62.396   0.29     5.29    4      172.9       15.8
  210   8   4  -3 31.259  62.518   0.29     5.27    4       73.5        2.8
  211   3   3  -5 31.268  62.536   0.29     5.27    4       95.2        4.8
  212   4   2   4 31.35   62.7     0.291    5.24    4      218.6       25.0
  213   1   7   0 31.41   62.82    0.291    5.21    4       62.5        2.0
  214   5   5   2 31.562  63.124   0.293    5.16    4       86.8        3.9
  215   2   6  -3 31.751  63.503   0.294    5.09    4      132.5        8.9
  216   3   5   3 31.765  63.529   0.294    5.09    4      166.0       14.0
  217   1   7  -1 31.833  63.665   0.295    5.06    4      179.1       16.2
  218   3   5  -4 31.886  63.773   0.295    5.05    4       63.4        2.0
  219   2   4   4 31.917  63.833   0.296    5.03    4       90.9        4.2
  220   1   3  -5 31.933  63.867   0.296    5.03    4       80.7        3.3
  221  10   2  -3 31.937  63.873   0.296    5.03    4      179.9       16.3
  222   5   3  -5 31.962  63.924   0.296    5.02    4       79.4        3.2
  223   8   2   2 32.008  64.016   0.296    5.0     4      137.6        9.5
  224   1   5  -4 32.145  64.29    0.297    4.96    4       66.4        2.2
  225   6   6  -1 32.188  64.376   0.298    4.94    4       42.4        0.9
  226   1   7   1 32.235  64.47    0.298    4.93    4      133.5        8.8
  227   0   6   3 32.283  64.566   0.299    4.91    4      117.1        6.7
  228  10   2   0 32.383  64.766   0.299    4.88    4       63.8        2.0
  229   7   5  -3 32.482  64.963   0.3      4.85    4      200.9       19.6
  230   7   1   3 32.534  65.067   0.301    4.83    4      164.9       13.1
  231   4   6  -3 32.568  65.137   0.301    4.82    4       47.3        1.1
  232   5   1   4 32.625  65.25    0.301    4.8     4       44.1        0.9
  233   8   4   1 32.73   65.461   0.302    4.77    4       81.8        3.2
  234   3   7   0 32.759  65.518   0.302    4.76    4       53.3        1.3
  235   6   6   0 32.769  65.539   0.303    4.76    4       22.6        0.2
  236   3   7  -1 32.776  65.553   0.303    4.75    4      121.2        7.0
  237   6   6  -2 32.838  65.676   0.303    4.73    4      291.3       40.1
  238  10   0  -4 32.865  65.73    0.303    4.73    2      110.2        2.9
  239  11   1  -2 32.931  65.862   0.304    4.71    4       40.1        0.8
  240   5   5  -4 32.971  65.941   0.304    4.69    4       82.9        3.2
  241   7   5   1 33.139  66.278   0.306    4.64    4       74.4        2.6
  242  11   1  -1 33.275  66.55    0.307    4.6     4       33.2        0.5
  243   9   3   1 33.342  66.685   0.307    4.58    4      141.2        9.1
  244   4   6   2 33.473  66.945   0.308    4.55    4      173.1       13.6
  245   1   7  -2 33.476  66.953   0.308    4.54    4       82.6        3.1
  246   9   3  -4 33.596  67.192   0.309    4.51    4      118.6        6.3
  247   2   2   5 33.685  67.37    0.31     4.49    4      103.1        4.8
  248   1   5   4 33.73   67.46    0.31     4.47    4      223.3       22.3
  249   8   2  -5 33.755  67.51    0.311    4.47    4       96.5        4.2
  250  11   1  -3 33.803  67.606   0.311    4.45    4       98.2        4.3
  251   2   4  -5 33.855  67.711   0.311    4.44    4      234.5       24.4
  252   4   4  -5 33.869  67.739   0.312    4.43    4       32.7        0.5
  253   1   3   5 33.916  67.831   0.312    4.42    4       55.3        1.4
  254   3   7   1 33.957  67.915   0.312    4.41    4      131.3        7.6
  255   8   4  -4 33.969  67.938   0.312    4.41    4       38.0        0.6
  256   7   3  -5 33.971  67.943   0.312    4.41    4      104.0        4.8
  257   3   7  -2 34.008  68.016   0.313    4.4     4       82.7        3.0
  258   2   6   3 34.13   68.259   0.314    4.36    4      109.8        5.3
  259   9   1   2 34.193  68.385   0.314    4.35    4      136.9        8.1
  260  10   2  -4 34.231  68.462   0.314    4.34    4      188.6       15.4
  261   1   7   2 34.258  68.516   0.315    4.33    4       28.4        0.3
  262   4   0  -6 34.283  68.565   0.315    4.32    2      163.2        5.8
  263   3   1   5 34.46   68.921   0.316    4.28    4       75.2        2.4
  264   9   1  -5 34.543  69.087   0.317    4.26    4       76.1        2.5
  265   6   6   1 34.55   69.101   0.317    4.26    4       68.0        2.0
  266   3   1  -6 34.644  69.288   0.318    4.23    4      104.2        4.6
  267   2   0  -6 34.656  69.313   0.318    4.23    2       74.3        1.2
  268   6   6  -3 34.684  69.367   0.318    4.22    4      102.5        4.4
  269  11   1   0 34.818  69.635   0.319    4.19    4       52.9        1.2
  270   6   0   4 34.875  69.751   0.32     4.17    2       31.6        0.2
  271   6   4   3 34.918  69.837   0.32     4.16    4      114.9        5.5
  272   5   1  -6 34.92   69.839   0.32     4.16    4       56.4        1.3
  273  10   2   1 34.948  69.897   0.32     4.16    4       80.3        2.7
  274  10   4  -2 34.973  69.946   0.32     4.15    4       50.9        1.1
  275   5   7  -1 35.009  70.018   0.321    4.14    4       57.6        1.4
  276  10   4  -1 35.116  70.232   0.322    4.12    4       32.6        0.4
  277   0   4   5 35.142  70.285   0.322    4.11    4       55.4        1.3
  278   6   4  -5 35.183  70.367   0.322    4.1     4       48.4        1.0
  279   6   0  -6 35.207  70.413   0.322    4.1     2       42.8        0.4
  280   9   5  -1 35.251  70.503   0.323    4.09    4       76.8        2.4
  281   7   3   3 35.252  70.505   0.323    4.09    4       15.0        0.1
  282   9   5  -2 35.301  70.602   0.323    4.07    4      107.5        4.7
  283   7   5  -4 35.335  70.669   0.323    4.07    4      110.3        4.9
  284   5   3   4 35.34   70.681   0.323    4.06    4      126.5        6.5
  285   5   7   0 35.377  70.753   0.324    4.06    4       82.5        2.8
  286   4   4   4 35.459  70.919   0.324    4.04    4       61.3        1.5
  287   5   5   3 35.575  71.149   0.325    4.01    4      112.7        5.1
  288   2   6  -4 35.595  71.191   0.325    4.01    4      196.0       15.4
  289   4   2  -6 35.622  71.244   0.326    4.0     4       85.7        2.9
  290  11   3  -2 35.635  71.269   0.326    4.0     4      125.7        6.3
  291   1   1  -6 35.659  71.318   0.326    3.99    4      107.7        4.6
  292   5   7  -2 35.824  71.649   0.327    3.96    4       42.9        0.7
  293  11   1  -4 35.848  71.697   0.327    3.95    4      135.2        7.2
  294  12   0  -2 35.949  71.899   0.328    3.93    2      108.5        2.3
  295  11   3  -1 35.967  71.933   0.328    3.93    4      169.3       11.2
  296   2   2  -6 35.99   71.979   0.328    3.92    4       44.4        0.8
  297   4   6  -4 35.99   71.98    0.328    3.92    4       42.0        0.7
  298  10   4  -3 36.012  72.024   0.329    3.92    4       85.7        2.9
  299   8   4   2 36.079  72.159   0.329    3.9     4       33.4        0.4
  300   6   2   4 36.205  72.411   0.33     3.88    4       53.0        1.1
  301   1   7  -3 36.259  72.519   0.331    3.87    4      152.6        9.0
  302   7   5   2 36.281  72.562   0.331    3.86    4      149.1        8.6
  303   0   0   6 36.31   72.62    0.331    3.85    2      141.0        3.8
  304   3   7   2 36.313  72.626   0.331    3.85    4       63.4        1.5
  305   0   8   0 36.349  72.698   0.331    3.85    2        6.7        0.0
  306   8   6  -1 36.369  72.737   0.331    3.84    4       35.8        0.5
  307   9   5   0 36.378  72.756   0.332    3.84    4      181.8       12.7
  308   3   7  -3 36.395  72.789   0.332    3.84    4       47.6        0.9
  309  10   4   0 36.434  72.868   0.332    3.83    4       76.8        2.3
  310   7   1  -6 36.473  72.947   0.332    3.82    4      148.0        8.4
  311  11   3  -3 36.477  72.953   0.332    3.82    4      174.6       11.6
  312   0   6   4 36.478  72.956   0.332    3.82    4      110.6        4.7
  313   9   5  -3 36.525  73.05    0.333    3.81    4      102.3        4.0
  314   6   2  -6 36.531  73.063   0.333    3.81    4       51.1        1.0
  315   3   5   4 36.558  73.116   0.333    3.81    4      101.0        3.9
  316   8   2   3 36.564  73.129   0.333    3.8     4       78.3        2.3
  317   8   6  -2 36.607  73.213   0.333    3.8     4      233.9       20.8
  318   3   5  -5 36.704  73.408   0.334    3.78    4       65.6        1.6
  319   9   3   2 36.854  73.707   0.335    3.75    4       76.2        2.2
  320   5   7   1 36.912  73.824   0.336    3.74    4       82.1        2.5
  321   0   8   1 36.932  73.863   0.336    3.73    4      190.7       13.6
  322   2   8   0 36.983  73.965   0.336    3.72    4       78.6        2.3
  323   3   3   5 37.113  74.227   0.337    3.7     4      117.8        5.1
  324   2   8  -1 37.187  74.374   0.338    3.69    4      115.7        4.9
  325   9   3  -5 37.194  74.388   0.338    3.68    4       71.1        1.9
  326   4   6   3 37.199  74.397   0.338    3.68    4      111.0        4.5
  327  12   2  -2 37.263  74.527   0.338    3.67    4       69.4        1.8
  328  10   0   2 37.285  74.57    0.339    3.67    2      115.8        2.5
  329   3   3  -6 37.291  74.582   0.339    3.67    4      106.4        4.1
  330   8   6   0 37.295  74.589   0.339    3.67    4      251.8       23.2
  331   1   5  -5 37.322  74.644   0.339    3.66    4       48.1        0.8
  332   5   5  -5 37.349  74.698   0.339    3.66    4       80.7        2.4
  333   8   0  -6 37.386  74.773   0.339    3.65    2       65.4        0.8
  334   1   7   3 37.39   74.78    0.339    3.65    4       74.0        2.0
  335   6   6   2 37.453  74.906   0.34     3.64    4      303.1       33.4
  336  11   3   0 37.46   74.92    0.34     3.64    4       95.3        3.3
  337  11   1   1 37.492  74.984   0.34     3.63    4      154.6        8.7
  338   4   2   5 37.522  75.044   0.34     3.63    4       96.8        3.4
  339   5   3  -6 37.559  75.118   0.341    3.62    4       80.5        2.3
  340  10   2  -5 37.616  75.231   0.341    3.61    4      100.8        3.7
  341   0   2   6 37.619  75.238   0.341    3.61    4       28.8        0.3
  342   6   6  -4 37.646  75.292   0.341    3.6     4       58.5        1.2
  343   2   4   5 37.671  75.343   0.342    3.6     4        6.7        0.0
  344   8   4  -5 37.738  75.476   0.342    3.59    4      257.4       23.8
  345  12   2  -1 37.777  75.553   0.342    3.58    4       95.4        3.3
  346   5   7  -3 37.791  75.582   0.343    3.58    4      123.5        5.5
  347  12   2  -3 37.905  75.81    0.343    3.56    4       13.7        0.1
  348   1   1   6 37.922  75.844   0.344    3.56    4       78.9        2.2
  349   2   8   1 37.935  75.87    0.344    3.55    4       63.2        1.4
  350   8   6  -3 38.0    76.001   0.344    3.54    4       72.9        1.9
  351   7   1   4 38.027  76.054   0.344    3.54    4       90.6        2.9
  352  12   0   0 38.142  76.283   0.345    3.52    2      262.6       12.1
  353  10   4  -4 38.193  76.386   0.346    3.51    4      125.9        5.6
  354   1   3  -6 38.278  76.556   0.346    3.5     4      147.3        7.6
  355  12   0  -4 38.398  76.795   0.347    3.48    2       42.7        0.3
  356   7   7  -1 38.434  76.868   0.347    3.47    4      153.2        8.2
  357  11   3  -4 38.463  76.925   0.348    3.47    4       82.4        2.4
  358   2   8  -2 38.541  77.082   0.348    3.46    4      233.7       18.9
  359  10   2   2 38.582  77.165   0.349    3.45    4       32.6        0.4
  360   2   6   4 38.604  77.207   0.349    3.45    4       73.4        1.9
  361   9   5   1 38.641  77.282   0.349    3.44    4       69.7        1.7
  362   0   8   2 38.66   77.321   0.349    3.44    4       91.2        2.9
  363   8   2  -6 38.683  77.365   0.349    3.44    4       42.5        0.6
  364   4   8  -1 38.692  77.384   0.349    3.43    4       63.3        1.4
  365   9   1   3 38.817  77.634   0.35     3.42    4       29.5        0.3
  366   7   7  -2 38.853  77.705   0.351    3.41    4       96.8        3.2
  367   4   8   0 38.861  77.722   0.351    3.41    4       75.0        1.9
  368   9   5  -4 38.88   77.761   0.351    3.41    4       57.9        1.1
  369  10   4   1 38.881  77.762   0.351    3.41    4       84.1        2.4
  370   5   1   5 38.887  77.774   0.351    3.41    4      126.7        5.5
  371  11   1  -5 38.993  77.985   0.352    3.39    4      169.3        9.7
  372   7   3  -6 39.072  78.145   0.352    3.38    4      110.4        4.1
  373   7   7   0 39.159  78.317   0.353    3.37    4       66.7        1.5
  374   2   0   6 39.18   78.359   0.353    3.36    2       80.6        1.1
  375   1   5   5 39.182  78.364   0.353    3.36    4      107.8        3.9
  376   7   5  -5 39.235  78.47    0.354    3.36    4      110.0        4.1
  377   9   1  -6 39.247  78.494   0.354    3.35    4      100.2        3.4
  378   8   6   1 39.355  78.711   0.354    3.34    4       53.5        1.0
  379  12   2   0 39.43   78.86    0.355    3.33    4      129.7        5.6
  380   4   4  -6 39.53   79.059   0.356    3.32    4      270.3       24.2
  381   5   7   2 39.565  79.129   0.356    3.31    4       58.3        1.1
  382   4   8  -2 39.663  79.326   0.357    3.3     4      110.9        4.1
  383  12   2  -4 39.684  79.367   0.357    3.3     4       18.9        0.1
  384   3   7   3 39.749  79.498   0.357    3.29    4      131.6        5.7
  385  13   1  -2 39.818  79.636   0.358    3.28    4       63.6        1.3
  386   3   7  -4 39.86   79.72    0.358    3.27    4       23.0        0.2
  387   2   4  -6 39.884  79.769   0.358    3.27    4      209.7       14.4
  388   2   8   2 40.017  80.035   0.359    3.25    4       21.1        0.1
  389  11   3   1 40.07   80.139   0.36     3.25    4      149.9        7.3
  390   6   4   4 40.093  80.185   0.36     3.24    4      139.1        6.3
  391   1   7  -4 40.096  80.192   0.36     3.24    4       26.7        0.2
  392   4   8   1 40.167  80.333   0.361    3.23    4       73.2        1.7
  393  13   1  -3 40.264  80.528   0.361    3.22    4      120.4        4.7
  394   7   7  -3 40.405  80.809   0.362    3.21    4      103.5        3.4
  395   2   6  -5 40.405  80.809   0.362    3.21    4       69.8        1.6
  396   6   4  -6 40.409  80.817   0.362    3.2     4       60.6        1.2
  397   4   6  -5 40.418  80.835   0.362    3.2     4       84.2        2.3
  398   8   4   3 40.441  80.881   0.363    3.2     4       26.6        0.2
  399   7   5   3 40.452  80.904   0.363    3.2     4       75.3        1.8
  400   2   2   6 40.458  80.917   0.363    3.2     4       60.7        1.2
  401   1   3   6 40.491  80.982   0.363    3.2     4       90.6        2.6
  402  13   1  -1 40.504  81.009   0.363    3.19    4       83.7        2.2
  403   8   6  -4 40.511  81.023   0.363    3.19    4       87.3        2.4
  404   5   5   4 40.536  81.073   0.363    3.19    4      119.9        4.6
  405   7   3   4 40.594  81.188   0.364    3.18    4      147.2        6.9
  406  10   0  -6 40.754  81.508   0.365    3.17    2      171.3        4.6
  407   8   0   4 40.766  81.531   0.365    3.16    2       54.2        0.5
  408  11   5  -2 40.818  81.635   0.365    3.16    4      158.5        7.9
  409   5   7  -4 40.855  81.709   0.366    3.15    4      143.2        6.5
  410   7   7   1 41.01   82.02    0.367    3.14    4       40.0        0.5
  411   2   8  -3 41.012  82.023   0.367    3.14    4       27.6        0.2
  412  12   4  -2 41.119  82.239   0.368    3.13    4       80.9        2.0
  413  11   5  -1 41.136  82.272   0.368    3.12    4       94.0        2.8
  414  11   1   2 41.23   82.461   0.368    3.11    4       33.2        0.3
  415   3   1   6 41.368  82.736   0.369    3.1     4       75.9        1.8
  416   4   4   5 41.371  82.742   0.369    3.1     4      127.6        5.0
  417   9   3   3 41.371  82.742   0.369    3.1     4       62.8        1.2
  418   6   6   3 41.406  82.811   0.37     3.1     4      168.7        8.8
  419   6   8  -1 41.407  82.814   0.37     3.1     4       30.7        0.3
  420   5   3   5 41.44   82.88    0.37     3.09    4       27.8        0.2
  421  10   6  -2 41.457  82.915   0.37     3.09    4       62.6        1.2
  422  10   4  -5 41.462  82.924   0.37     3.09    4       32.1        0.3
  423   0   4   6 41.465  82.931   0.37     3.09    4       77.2        1.8
  424   5   1  -7 41.468  82.936   0.37     3.09    4       26.0        0.2
  425   0   8   3 41.494  82.987   0.37     3.09    4       65.1        1.3
  426  11   3  -5 41.544  83.088   0.371    3.08    4       35.7        0.4
  427   1   7   4 41.558  83.116   0.371    3.08    4       42.5        0.6
  428   3   1  -7 41.572  83.144   0.371    3.08    4       87.7        2.4
  429  10   6  -1 41.593  83.185   0.371    3.08    4       16.5        0.1
  430   0   6   5 41.618  83.235   0.371    3.07    4       64.3        1.3
  431  12   4  -1 41.619  83.238   0.371    3.07    4       78.6        1.9
  432  11   5  -3 41.626  83.252   0.371    3.07    4       92.6        2.6
  433   6   6  -5 41.657  83.313   0.372    3.07    4       57.4        1.0
  434  12   4  -3 41.744  83.489   0.372    3.06    4       80.6        2.0
  435   4   8  -3 41.754  83.508   0.372    3.06    4       14.3        0.1
  436   9   3  -6 41.795  83.589   0.373    3.06    4      141.3        6.1
  437  13   1  -4 41.835  83.67    0.373    3.05    4      101.8        3.2
  438   4   6   4 41.919  83.837   0.373    3.05    4      137.9        5.8
  439   6   8   0 41.938  83.875   0.374    3.04    4      150.1        6.9
  440   1   9   0 41.972  83.945   0.374    3.04    4       28.9        0.3
  441   9   5   2 41.989  83.979   0.374    3.04    4       85.5        2.2
  442   6   8  -2 42.0    84.001   0.374    3.04    4      113.6        3.9
  443  10   2  -6 42.022  84.044   0.374    3.04    4       76.4        1.8
  444   8   2   4 42.034  84.067   0.374    3.04    4        5.1        0.0
  445  12   2   1 42.188  84.377   0.375    3.02    4       17.0        0.1
  446   3   5   5 42.24   84.48    0.376    3.02    4       51.3        0.8
  447  13   1   0 42.312  84.623   0.376    3.01    4      116.2        4.1
  448   4   2  -7 42.316  84.633   0.376    3.01    4       27.1        0.2
  449   9   5  -5 42.318  84.636   0.376    3.01    4       71.5        1.5
  450   1   9  -1 42.351  84.703   0.377    3.01    4        1.0        0.0
  451  13   3  -2 42.358  84.717   0.377    3.01    4      117.2        4.1
  452  10   4   2 42.406  84.813   0.377    3.0     4       46.7        0.7
  453   3   5  -6 42.412  84.825   0.377    3.0     4       39.5        0.5
  454  10   6  -3 42.445  84.89    0.377    3.0     4       94.3        2.7
  455   6   2   5 42.447  84.894   0.377    3.0     4      236.0       16.7
  456   8   4  -6 42.505  85.009   0.378    2.99    4      196.2       11.5
  457   8   6   2 42.51   85.019   0.378    2.99    4       42.3        0.5
  458  12   2  -5 42.564  85.127   0.378    2.99    4      107.5        3.4
  459  11   5   0 42.576  85.151   0.378    2.99    4       67.0        1.3
  460   4   8   2 42.584  85.168   0.378    2.99    4       86.9        2.3
  461   7   1  -7 42.585  85.17    0.378    2.99    4      118.1        4.2
  462   5   5  -6 42.672  85.343   0.379    2.98    4       27.7        0.2
  463   1   9   1 42.714  85.429   0.379    2.98    4       92.0        2.5
  464  13   3  -3 42.8    85.599   0.38     2.97    4       85.7        2.2
  465   6   2  -7 42.822  85.644   0.38     2.97    4       71.7        1.5
  466  10   6   0 42.849  85.698   0.38     2.97    4       36.3        0.4
  467   1   1  -7 42.896  85.792   0.38     2.96    4      136.4        5.5
  468   9   7  -1 42.985  85.969   0.381    2.96    4      136.1        5.5
  469   2   2  -7 43.029  86.058   0.381    2.95    4       72.4        1.5
  470   9   7  -2 43.031  86.063   0.381    2.95    4       71.7        1.5
  471  13   3  -1 43.037  86.075   0.382    2.95    4       40.7        0.5
  472   7   7  -4 43.063  86.127   0.382    2.95    4       48.6        0.7
  473  11   1  -6 43.185  86.37    0.383    2.94    4       43.6        0.6
  474   3   9   0 43.191  86.382   0.383    2.94    4       46.0        0.6
  475   2   8   3 43.193  86.386   0.383    2.94    4       28.1        0.2
  476   3   9  -1 43.207  86.413   0.383    2.94    4      221.3       14.4
  477   4   0   6 43.21   86.419   0.383    2.94    2      166.2        4.1
  478  10   2   3 43.233  86.467   0.383    2.94    4      107.6        3.4
  479  12   4   0 43.238  86.475   0.383    2.94    4       58.0        1.0
  480  14   0  -2 43.267  86.534   0.383    2.93    2      199.0        5.8
  481   5   7   3 43.291  86.581   0.383    2.93    4       92.9        2.5
  482   1   5  -6 43.371  86.741   0.384    2.93    4       22.7        0.2
  483  12   4  -4 43.487  86.974   0.385    2.92    4       59.9        1.0
  484  11   5  -4 43.55   87.101   0.385    2.91    4       97.5        2.8
  485   6   8   1 43.586  87.172   0.385    2.91    4      208.0       12.6
  486   6   8  -3 43.711  87.421   0.386    2.9     4       84.6        2.1
  487  11   3   2 43.757  87.514   0.387    2.9     4       64.8        1.2
  488   1   9  -2 43.848  87.697   0.387    2.89    4      135.2        5.3
  489   3   3   6 43.893  87.787   0.388    2.89    4       98.8        2.8
  490   7   7   2 43.963  87.925   0.388    2.89    4       41.1        0.5
  491   5   3  -7 43.993  87.985   0.388    2.88    4       20.9        0.1
  492   2   6   5 44.041  88.082   0.389    2.88    4       69.4        1.4
  493   9   7   0 44.056  88.111   0.389    2.88    4        5.6        0.0
  494   3   3  -7 44.096  88.192   0.389    2.88    4       85.7        2.1
  495   8   6  -5 44.105  88.211   0.389    2.88    4       85.6        2.1
  496   7   5  -6 44.146  88.293   0.389    2.88    4       75.1        1.6
  497   9   7  -3 44.196  88.391   0.39     2.87    4       84.5        2.0
  498   3   7   4 44.227  88.454   0.39     2.87    4       35.5        0.4
  499   2   4   6 44.251  88.503   0.39     2.87    4       77.8        1.7
  500   3   9   1 44.293  88.585   0.39     2.87    4      130.7        4.9
  501   3   9  -2 44.339  88.679   0.391    2.86    4       30.7        0.3
  502  13   3  -4 44.357  88.715   0.391    2.86    4       51.9        0.8
  503   3   7  -5 44.367  88.735   0.391    2.86    4      122.2        4.3
  504   7   1   5 44.384  88.768   0.391    2.86    4      185.8        9.9
  505   9   1   4 44.399  88.798   0.391    2.86    4       97.6        2.7
  506   4   2   6 44.469  88.937   0.392    2.86    4      122.9        4.3
  507  13   1  -5 44.513  89.026   0.392    2.85    4       67.2        1.3
  508  14   2  -2 44.526  89.052   0.392    2.85    4       27.3        0.2
  509   8   2  -7 44.542  89.084   0.392    2.85    4      124.1        4.4
  510  10   6  -4 44.547  89.093   0.392    2.85    4      102.9        3.0
  511   2   8  -4 44.569  89.139   0.392    2.85    4       41.8        0.5
  512   1   9   2 44.572  89.144   0.392    2.85    4      141.0        5.7
  513  12   0   2 44.779  89.558   0.394    2.84    2       93.2        1.2
  514  14   2  -3 44.785  89.569   0.394    2.84    4      196.4       10.9
  515  13   3   0 44.832  89.663   0.394    2.84    4       60.7        1.0
  516  14   0  -4 44.901  89.803   0.395    2.83    2      212.1        6.4
  517   9   1  -7 44.913  89.825   0.395    2.83    4       13.6        0.1
  518   4   8  -4 44.944  89.888   0.395    2.83    4       99.5        2.8
  519   0   2   7 44.955  89.911   0.395    2.83    4       58.5        1.0
  520   1   7  -5 44.962  89.923   0.395    2.83    4      103.6        3.0
  521   5   7  -5 44.987  89.975   0.395    2.83    4       62.9        1.1


  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   1   1   0   5.176  10.351  9.91531      115.1     24.1     24.2     5.6
    2   2   0   0   5.908  11.816  8.68962      233.0     48.8     48.9     5.6
    3   1   1  -1   6.969  13.938  7.37191      477.4    100.0    100.0     5.6
    4   1   1   1   8.339  16.678  6.16737      445.7     93.4     93.2     5.6
    5   0   2   0   8.521  17.042  6.0365        92.7     19.4     19.4     5.6
    6   3   1   0   9.861  19.722  5.22292      103.3     21.6     21.6     5.6
    7   3   1  -1   9.907  19.814  5.19889       59.8     12.5     12.5     5.6
    8   0   2   1  10.255  20.51   5.02411       56.3     11.8     11.8     5.6
    9   2   2   0  10.394  20.788  4.95765       61.4     12.9     12.8     5.6
   10   2   2  -1  10.934  21.868  4.71558       20.8      4.4      4.3     5.6
   11   2   0  -2  11.08   22.16   4.65439       27.5      5.8      5.7     5.6
   12   0   0   2  11.384  22.768  4.53158       19.4      4.1      4.0     5.6
   13   1   1  -2  11.651  23.303  4.429        104.1     21.8     21.7     5.6
   14   4   0   0  11.88   23.761  4.34481       48.5     10.2     10.1     5.6
   15   3   1  -2  12.836  25.671  4.0263        21.3      4.5      4.4     5.6
   16   1   3   0  13.188  26.376  3.92059       21.2      4.4      4.4     5.6
   17   1   1   2  13.362  26.724  3.87033       12.5      2.6      2.6     5.6
   18   4   0  -2  13.7    27.4    3.77663       13.3      2.8      2.8     5.6
   19   1   3  -1  14.013  28.026  3.69392       12.8      2.7      2.7     5.6
   20   2   2  -2  14.044  28.088  3.68596        5.1      1.1      1.1     5.6
   21   0   2   2  14.289  28.578  3.62405        8.0      1.7      1.7     5.6
   22   4   2  -1  14.353  28.706  3.60817       17.5      3.7      3.6     5.6
   23   2   0   2  14.44   28.879  3.58703        5.4      1.1      1.1     5.6
   24   4   2   0  14.694  29.387  3.52637       54.9     11.5     11.4     5.6
   25   1   3   1  14.764  29.529  3.50982       17.8      3.7      3.7     5.6
   26   5   1  -1  14.848  29.697  3.49041       17.6      3.7      3.6     5.6
   27   5   1   0  15.533  31.065  3.34017       18.1      3.8      3.7     5.6
   28   3   3   0  15.702  31.404  3.3051        18.2      3.8      3.8     5.6
   29   3   3  -1  15.732  31.463  3.29899      224.3     47.0     46.4     5.6
   30   4   2  -2  16.223  32.446  3.20167       24.6      5.2      5.1     5.6
   31   5   1  -2  16.336  32.671  3.18013      144.1     30.2     29.8     5.6
   32   2   2   2  16.862  33.723  3.08368       35.8      7.5      7.4     5.7
   33   1   3  -2  16.92   33.839  3.07344       44.7      9.4      9.2     5.7
   34   1   1  -3  17.087  34.174  3.04425       19.6      4.1      4.0     5.7
   35   3   1   2  17.178  34.356  3.02858      125.7     26.3     25.9     5.7
   36   0   4   0  17.239  34.477  3.01825       68.5     14.3     14.1     5.7
   37   3   1  -3  17.315  34.631  3.00526        4.8      1.0      1.0     5.7
   38   3   3   1  17.701  35.403  2.94178      380.1     79.6     78.4     5.7
   39   3   3  -2  17.782  35.564  2.92889       14.4      3.0      3.0     5.7
   40   6   0   0  17.987  35.974  2.89654      222.6     46.6     45.8     5.7
   41   6   0  -2  18.093  36.186  2.88017        5.4      1.1      1.1     5.7
   42   5   1   1  18.169  36.338  2.86852       17.0      3.6      3.5     5.7
   43   0   4   1  18.201  36.402  2.86363      162.2     34.0     33.4     5.7
   44   2   4   0  18.283  36.567  2.85116       27.5      5.8      5.7     5.7
   45   2   2  -3  18.556  37.113  2.81066      428.0     89.7     88.1     5.7
   46   2   4  -1  18.611  37.221  2.80277       16.7      3.5      3.4     5.7
   47   1   1   3  18.932  37.864  2.75686       47.7     10.0      9.8     5.7
   48   4   0   2  19.055  38.111  2.73969       17.6      3.7      3.6     5.7
   49   6   2  -1  19.197  38.394  2.72026      130.6     27.4     26.9     5.7
   50   5   3  -1  19.331  38.663  2.70203       83.4     17.5     17.1     5.7
   51   5   1  -3  19.555  39.11   2.67235      134.8     28.2     27.7     5.7
   52   5   3   0  19.879  39.758  2.63051        7.1      1.5      1.5     5.7
   53   6   2   0  20.03   40.06   2.61146       44.7      9.4      9.2     5.7
   54   6   2  -2  20.127  40.253  2.59944       17.6      3.7      3.6     5.7
   55   7   1  -1  20.525  41.05   2.55112       54.0     11.3     11.1     5.7
   56   2   4  -2  20.684  41.367  2.5324        10.5      2.2      2.2     5.7
   57   0   4   2  20.859  41.718  2.51205       23.5      4.9      4.8     5.7
   58   4   2   2  21.01   42.02   2.49477        5.3      1.1      1.1     5.7
   59   4   4   0  21.152  42.304  2.47883       17.9      3.7      3.7     5.7
   60   3   3   2  21.231  42.462  2.47          59.6     12.5     12.2     5.7
   61   3   3  -3  21.346  42.692  2.4573        33.2      7.0      6.8     5.7
   62   7   1   0  21.581  43.161  2.43186       43.7      9.1      8.9     5.7
   63   2   2   3  21.902  43.805  2.39785        6.4      1.3      1.3     5.7
   64   2   0  -4  22.071  44.141  2.38047       60.1     12.6     12.3     5.7
   65   5   1   2  22.156  44.313  2.37171        7.8      1.6      1.6     5.7
   66   3   1   3  22.415  44.829  2.34578       16.2      3.4      3.3     5.7
   67   6   2   1  22.463  44.926  2.34097       19.4      4.1      4.0     5.7
   68   1   5  -1  22.501  45.002  2.33725        9.9      2.1      2.0     5.7
   69   3   1  -4  22.569  45.138  2.33058        9.6      2.0      2.0     5.7
   70   6   2  -3  22.639  45.278  2.32373        7.9      1.6      1.6     5.7
   71   1   3   3  22.721  45.441  2.31584       25.7      5.4      5.3     5.7
   72   2   4   2  22.787  45.574  2.30946        5.9      1.2      1.2     5.7
   73   1   1  -4  22.895  45.79   2.29913       13.5      2.8      2.7     5.7
   74   4   4   1  22.992  45.984  2.28995        6.8      1.4      1.4     5.7
   75   0   0   4  23.251  46.503  2.26579        7.0      1.5      1.4     5.7
   76   7   1  -3  23.317  46.633  2.25982       12.8      2.7      2.6     5.7
   77   8   0  -2  23.421  46.841  2.25033        8.2      1.7      1.7     5.7
   78   2   2  -4  23.823  47.646  2.2145        82.6     17.3     16.8     5.7
   79   2   4  -3  24.131  48.263  2.18785       22.8      4.8      4.6     5.7
   80   8   0   0  24.314  48.628  2.1724        40.4      8.5      8.2     5.7
   81   1   5  -2  24.542  49.084  2.15347        7.2      1.5      1.5     5.7
   82   6   4  -1  24.653  49.305  2.14439       22.1      4.6      4.5     5.7
   83   6   0  -4  24.763  49.527  2.1354         6.6      1.4      1.3     5.7
   84   1   1   4  24.85   49.7    2.12844       11.4      2.4      2.3     5.7
   85   7   3   0  25.044  50.088  2.11299        9.8      2.1      2.0     5.7
   86   3   5   1  25.124  50.249  2.10667        8.4      1.8      1.7     5.8
   87   3   5  -2  25.185  50.37   2.10192       15.0      3.1      3.0     5.8
   88   6   4  -2  25.421  50.842  2.08369        5.5      1.2      1.1     5.8
   89   1   5   2  25.486  50.971  2.07876        8.9      1.9      1.8     5.8
   90   5   3   2  25.559  51.118  2.07318       13.5      2.8      2.7     5.8
   91   3   3   3  25.791  51.582  2.05579        7.5      1.6      1.5     5.8
   92   4   2   3  25.833  51.665  2.05273       18.4      3.9      3.7     5.8
   93   4   4   2  26.163  52.326  2.0286        45.9      9.6      9.3     5.8
   94   1   3  -4  26.225  52.449  2.02417       15.8      3.3      3.2     5.8
   95   5   5  -1  26.379  52.758  2.01317       15.1      3.2      3.1     5.8
   96   9   1  -1  26.664  53.328  1.9932        19.9      4.2      4.0     5.8
   97   8   2  -3  26.808  53.615  1.9833        43.4      9.1      8.8     5.8
   98   5   1   3  27.043  54.086  1.96733        8.1      1.7      1.6     5.8
   99   0   6   1  27.087  54.175  1.96434       10.3      2.2      2.1     5.8
  100   2   6   0  27.148  54.296  1.9603         9.3      1.9      1.9     5.8
  101   5   5  -2  27.334  54.668  1.94795       43.0      9.0      8.7     5.8
  102   6   4   1  27.405  54.811  1.94329       49.5     10.4     10.0     5.8
  103   6   4  -3  27.557  55.115  1.93339        8.7      1.8      1.8     5.8
  104   1   5  -3  27.838  55.676  1.91543       12.6      2.6      2.5     5.8
  105   9   1   0  27.975  55.951  1.90679       12.9      2.7      2.6     5.8
  106   1   3   4  28.008  56.015  1.90477       10.4      2.2      2.1     5.8
  107   9   1  -3  28.144  56.288  1.89628        9.3      1.9      1.9     5.8
  108   8   0  -4  28.274  56.547  1.88832       41.2      8.6      8.3     5.8
  109   8   2   1  28.417  56.835  1.87955        7.9      1.7      1.6     5.8
  110   5   5   1  28.588  57.176  1.86928       17.4      3.6      3.5     5.8
  111   2   6  -2  28.966  57.932  1.84696       40.6      8.5      8.2     5.8
  112   1   1  -5  29.055  58.111  1.84177       12.8      2.7      2.6     5.8
  113   0   6   2  29.103  58.206  1.83902       93.8     19.7     18.8     5.8
  114   1   5   3  29.132  58.265  1.83732       11.0      2.3      2.2     5.8
  115   8   4  -1  29.457  58.915  1.81884       11.6      2.4      2.3     5.8
  116   5   5  -3  29.586  59.172  1.81165        9.6      2.0      1.9     5.8
  117   2   2  -5  29.634  59.268  1.80896       39.1      8.2      7.8     5.8
  118   9   3  -1  29.688  59.375  1.806         17.6      3.7      3.5     5.8
  119   8   4  -2  29.722  59.445  1.80409       46.7      9.8      9.4     5.8
  120   8   2  -4  29.757  59.513  1.8022        32.9      6.9      6.6     5.8
  121   4   0   4  29.915  59.831  1.79352       14.7      3.1      2.9     5.8
  122   7   5  -1  30.308  60.616  1.77245       18.1      3.8      3.6     5.8
  123   4   4   3  30.378  60.757  1.76873        9.0      1.9      1.8     5.8
  124   8   4   0  30.484  60.968  1.76318       24.1      5.0      4.8     5.8
  125   9   1   1  30.539  61.078  1.76031       19.7      4.1      3.9     5.8
  126   8   0   2  30.591  61.182  1.75761       11.9      2.5      2.4     5.8
  127   6   4   2  30.658  61.317  1.75413        9.8      2.0      2.0     5.8
  128   6   2   3  30.774  61.548  1.74819       33.8      7.1      6.8     5.8
  129  10   2  -2  30.832  61.664  1.7452        13.4      2.8      2.7     5.8
  130  10   2  -1  30.984  61.969  1.73748        5.3      1.1      1.1     5.8
  131   9   3  -3  31.074  62.148  1.73296        9.0      1.9      1.8     5.8
  132   1   1   5  31.14   62.279  1.72967       32.5      6.8      6.5     5.8
  133   7   1  -5  31.198  62.396  1.72676       15.8      3.3      3.2     5.8
  134   3   3  -5  31.268  62.536  1.7233         7.6      1.6      1.5     5.8
  135   4   2   4  31.35   62.7    1.71924       25.0      5.2      5.0     5.8
  136   3   5   3  31.765  63.529  1.6991        22.9      4.8      4.6     5.9
  137   1   7  -1  31.833  63.665  1.69585       16.2      3.4      3.2     5.9
  138  10   2  -3  31.937  63.873  1.69091       26.9      5.6      5.3     5.9
  139   8   2   2  32.008  64.016  1.68754        9.5      2.0      1.9     5.9
  140   1   7   1  32.235  64.47   1.67693        8.8      1.8      1.7     5.9
  141   0   6   3  32.283  64.566  1.6747         6.7      1.4      1.3     5.9
  142   7   5  -3  32.482  64.963  1.66557       19.6      4.1      3.9     5.9
  143   7   1   3  32.534  65.067  1.6632        13.1      2.7      2.6     5.9
  144   3   7  -1  32.776  65.553  1.65224        7.0      1.5      1.4     5.9
  145   6   6  -2  32.838  65.676  1.64949       43.0      9.0      8.5     5.9
  146   9   3   1  33.342  66.685  1.62736        9.1      1.9      1.8     5.9
  147   4   6   2  33.473  66.945  1.62176       16.7      3.5      3.3     5.9
  148   9   3  -4  33.596  67.192  1.61649        6.3      1.3      1.3     5.9
  149   1   5   4  33.73   67.46   1.61082       26.4      5.5      5.2     5.9
  150   2   4  -5  33.855  67.711  1.60557       24.9      5.2      4.9     5.9
  151   3   7   1  33.957  67.915  1.60132       13.0      2.7      2.6     5.9
  152   2   6   3  34.13   68.259  1.59421        5.3      1.1      1.0     5.9
  153   9   1   2  34.193  68.385  1.59163        8.1      1.7      1.6     5.9
  154  10   2  -4  34.231  68.462  1.59007       15.8      3.3      3.1     5.9
  155   4   0  -6  34.283  68.565  1.58796        5.8      1.2      1.1     5.9
  156   3   1  -6  34.644  69.288  1.57344        5.8      1.2      1.1     5.9
  157   6   4   3  34.918  69.837  1.56262        6.8      1.4      1.3     5.9
  158   5   3   4  35.34   70.681  1.54635       11.4      2.4      2.3     5.9
  159   2   6  -4  35.595  71.191  1.53672       20.5      4.3      4.0     5.9
  160  11   3  -2  35.635  71.269  1.53525       13.9      2.9      2.7     5.9
  161  11   1  -4  35.848  71.697  1.52732        7.2      1.5      1.4     5.9
  162  11   3  -1  35.967  71.933  1.52297       13.6      2.8      2.7     5.9
  163   1   7  -3  36.259  72.519  1.51234       17.6      3.7      3.4     5.9
  164   0   0   6  36.31   72.62   1.51053        5.4      1.1      1.1     6.0
  165   9   5   0  36.378  72.756  1.50808       13.6      2.8      2.7     6.0
  166  11   3  -3  36.477  72.953  1.50457       24.7      5.2      4.8     6.0
  167   9   5  -3  36.525  73.05   1.50286        5.0      1.0      1.0     6.0
  168   3   5   4  36.558  73.116  1.5017         6.2      1.3      1.2     6.0
  169   8   6  -2  36.607  73.213  1.49997       20.8      4.3      4.1     6.0
  170   0   8   1  36.932  73.863  1.48863       16.1      3.4      3.1     6.0
  171   3   3   5  37.113  74.227  1.48238        5.1      1.1      1.0     6.0
  172   2   8  -1  37.187  74.374  1.47988       11.3      2.4      2.2     6.0
  173   8   6   0  37.295  74.589  1.47622       32.4      6.8      6.3     6.0
  174   6   6   2  37.453  74.906  1.47089       36.7      7.7      7.2     6.0
  175  11   1   1  37.492  74.984  1.46957       12.1      2.5      2.4     6.0
  176   8   4  -5  37.738  75.476  1.46141       23.8      5.0      4.6     6.0
  177   5   7  -3  37.791  75.582  1.45967        8.7      1.8      1.7     6.0
  178   7   1   4  38.027  76.054  1.45197        4.8      1.0      0.9     6.0
  179  12   0   0  38.142  76.283  1.44827       12.1      2.5      2.4     6.0
  180  10   4  -4  38.193  76.386  1.44662        5.6      1.2      1.1     6.0
  181   1   3  -6  38.278  76.556  1.44389        7.6      1.6      1.5     6.0
  182   7   7  -1  38.434  76.868  1.43894       10.5      2.2      2.0     6.0
  183   2   8  -2  38.541  77.082  1.43555       18.9      4.0      3.7     6.0
  184   7   7  -2  38.853  77.705  1.42584        8.7      1.8      1.7     6.0
  185   5   1   5  38.887  77.774  1.42479        5.5      1.1      1.1     6.0
  186  11   1  -5  38.993  77.985  1.42154        9.7      2.0      1.9     6.0
  187   1   5   5  39.182  78.364  1.41576        6.5      1.4      1.3     6.0
  188   7   5  -5  39.235  78.47   1.41416        7.4      1.6      1.4     6.0
  189  12   2   0  39.43   78.86   1.4083         5.6      1.2      1.1     6.0
  190   4   4  -6  39.53   79.059  1.40533       24.2      5.1      4.7     6.0
  191   3   7   3  39.749  79.498  1.39885        5.7      1.2      1.1     6.0
  192   2   4  -6  39.884  79.769  1.39489       14.4      3.0      2.8     6.0
  193  11   3   1  40.07   80.139  1.38952       13.8      2.9      2.7     6.0
  194   7   7  -3  40.405  80.809  1.37996        8.4      1.8      1.6     6.1
  195   1   3   6  40.491  80.982  1.37751        7.3      1.5      1.4     6.1
  196   7   3   4  40.594  81.188  1.37462        6.9      1.4      1.3     6.1
  197  10   0  -6  40.754  81.508  1.37016        5.1      1.1      1.0     6.1
  198  11   5  -2  40.818  81.635  1.3684         7.9      1.7      1.5     6.1
  199   5   7  -4  40.855  81.709  1.36738        6.5      1.4      1.2     6.1
  200  11   5  -1  41.136  82.272  1.35968        4.8      1.0      0.9     6.1
  201   4   4   5  41.371  82.742  1.35333        8.0      1.7      1.5     6.1
  202   6   6   3  41.406  82.811  1.3524         9.1      1.9      1.7     6.1
  203   0   4   6  41.465  82.931  1.35081        4.9      1.0      0.9     6.1
  204  11   5  -3  41.626  83.252  1.34654        5.8      1.2      1.1     6.1
  205   9   3  -6  41.795  83.589  1.3421         6.1      1.3      1.2     6.1
  206   6   8   0  41.938  83.875  1.33837       12.6      2.6      2.4     6.1
  207   6   8  -2  42.0    84.001  1.33674        7.9      1.7      1.5     6.1
  208  13   1   0  42.312  84.623  1.32874        5.8      1.2      1.1     6.1
  209   6   2   5  42.447  84.894  1.32531       19.4      4.1      3.7     6.1
  210   8   4  -6  42.505  85.009  1.32385       12.1      2.5      2.3     6.1
  211   7   1  -7  42.585  85.17   1.32183       11.2      2.3      2.1     6.1
  212   1   1  -7  42.896  85.792  1.31409        5.5      1.2      1.0     6.1
  213   9   7  -1  42.985  85.969  1.31191        5.5      1.1      1.0     6.1
  214   3   9  -1  43.207  86.413  1.30649       21.8      4.6      4.2     6.1
  215  14   0  -2  43.267  86.534  1.30503        8.3      1.7      1.6     6.1
  216   6   8   1  43.586  87.172  1.29737       12.6      2.6      2.4     6.2
  217   1   9  -2  43.848  87.697  1.29117        5.3      1.1      1.0     6.2
  218   3   9   1  44.293  88.585  1.28087        4.9      1.0      0.9     6.2
  219   7   1   5  44.384  88.768  1.27878       16.9      3.5      3.2     6.2
  220   1   9   2  44.572  89.144  1.27452       15.1      3.2      2.8     6.2
  221  14   2  -3  44.785  89.569  1.26974       12.2      2.6      2.3     6.2
  222  14   0  -4  44.901  89.803  1.26714        6.4      1.3      1.2     6.2
  223   1   7  -5  44.962  89.923  1.26581        7.9      1.7      1.5     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)