Vaesite
      Nowack E, Schwarzenbach D, Hahn T
      Acta Crystallographica B47 (1991) 650-659
      Charge densities in CoS2 and NiS2 (pyrite structure)
      Note: multipole model, T = 135 K
      Locality: synthetic
      _database_code_amcsd 0009853

      CELL PARAMETERS:    5.6765   5.6765   5.6765   90.000   90.000   90.000
      SPACE GROUP: Pa3       
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:    182.912
      Density (g/cm3):      4.460
      MAX. ABS. INTENSITY / VOLUME**2:      56.75507694    
      RIR:      4.144
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                27.21         29.95        3.2773    1   1   1         8
                31.52        100.00        2.8382    2   0   0         6
                35.36         33.59        2.5386    2   1   0        12
                38.86         30.91        2.3174    2   1   1        24
                45.18         50.37        2.0069    2   2   0        12
                48.09          1.46        1.8922    2   2   1        24
                53.54         80.73        1.7115    3   1   1        24
                56.13         15.29        1.6387    2   2   2         8
                58.64         14.25        1.5744    3   0   2        12
                61.08         15.53        1.5171    3   2   1        24
                61.08          1.86        1.5171    3   1   2        24
                68.11          1.05        1.3768    3   2   2        24
                70.37          1.07        1.3380    4   1   1        24
                72.59         14.20        1.3023    3   3   1        24
                74.80          5.23        1.2693    4   0   2        12
                74.80          5.23        1.2693    4   2   0        12
                76.98          4.41        1.2387    4   2   1        24
                79.14          1.91        1.2102    3   3   2        24
                83.41         10.96        1.1587    4   2   2        24
                85.54          1.15        1.1353    4   3   0        12
                87.66          1.36        1.1133    4   1   3        24
                89.77          3.88        1.0924    3   3   3         8
                89.77         27.52        1.0924    5   1   1        24
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       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.