Sulphur
      Rettig S J, Trotter J
      Acta Crystallographica C43 (1987) 2260-2262
      Refinement of the structure of orthorhombic sulfur, alpha-S8
      Locality: synthetic
      Sample: at T = 298 K
      Note: alpha phase
      Note: coordinate positions of atoms correspond to high-angle refinements
      _database_code_amcsd 0010057

      CELL PARAMETERS:   10.4646  12.8660  24.4860   90.000   90.000   90.000
      SPACE GROUP: Fddd      
      X-RAY WAVELENGTH:     1.541838
      Cell Volume:   3296.735
      Density (g/cm3):      2.067
      MAX. ABS. INTENSITY / VOLUME**2:      11.73793600    
      RIR:      1.849
      RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
               2-THETA      INTENSITY    D-SPACING   H   K   L   Multiplicity
                11.48          6.82        7.7058    1   1   1         8
                15.39         15.16        5.7559    1   1   3         8
                15.56          6.36        5.6947    0   2   2         4
                18.44          1.62        4.8113    2   0   2         4
                21.19          2.23        4.1933    1   1   5         8
                21.90         12.03        4.0592    2   2   0         4
                22.70         13.71        3.9172    1   3   1         8
                23.08        100.00        3.8529    2   2   2         8
                24.95          6.89        3.5689    1   3   3         8
                25.85         37.93        3.4461    0   2   6         4
                26.34          2.63        3.3830    2   2   4         8
                26.73         22.25        3.3353    3   1   1         8
                27.72         23.94        3.2179    2   0   6         4
                27.73         11.04        3.2165    0   4   0         2
                27.77         11.89        3.2125    1   1   7         8
                28.68         20.40        3.1123    3   1   3         8
                28.96         14.58        3.0832    1   3   5         8
                31.42         18.10        2.8474    0   4   4         4
                33.31          1.96        2.6897    3   3   1         8
                33.51          1.13        2.6740    2   4   2         8
                34.17         10.79        2.6241    1   3   7         8
                34.28          2.43        2.6161    4   0   0         2
                34.93          3.59        2.5686    3   3   3         8
                35.91          7.53        2.5010    2   4   4         8
                36.13          4.08        2.4859    1   5   1         8
                37.06         12.96        2.4257    3   1   7         8
                37.38          2.11        2.4057    4   0   4         4
                37.84          3.96        2.3773    4   2   2         8
                37.99          4.38        2.3685    3   3   5         8
                39.37          6.26        2.2884    0   2  10         4
                40.69          1.48        2.2173    0   4   8         4
                42.09          3.20        2.1468    1   1  11         8
                42.73          6.05        2.1161    3   1   9         8
                42.81          7.20        2.1122    0   6   2         4
                43.15          1.77        2.0967    2   2  10         8
                43.99          1.47        2.0585    5   1   1         8
                44.37          1.15        2.0415    2   4   8         8
                45.17          1.44        2.0071    3   5   3         8
                45.62          3.39        1.9887    4   0   8         4
                46.36          2.90        1.9586    2   6   2         8
                47.18          1.20        1.9265    4   4   4         8
                47.68          1.37        1.9072    3   5   5         8
                47.79          6.27        1.9034    5   1   5         8
                47.88          2.24        1.9000    4   2   8         8
                49.95          1.60        1.8258    2   4  10         8
                50.03          3.64        1.8231    2   2  12         8
                51.27         11.56        1.7819    3   5   7         8
                52.09          6.60        1.7558    5   3   5         8
                53.04          5.31        1.7267    6   0   2         4
                53.16          3.62        1.7230    0   4  12         4
                53.18          1.71        1.7224    4   2  10         8
                54.00          7.42        1.6980    1   7   5         8
                55.17          1.69        1.6649    2   6   8         8
                55.47          1.74        1.6566    5   3   7         8
                55.79          5.01        1.6478    3   5   9         8
                56.72          2.38        1.6231    6   2   4         8
                56.74          4.21        1.6225    3   7   1         8
                56.83          1.32        1.6201    5   5   1         8
                57.26          1.18        1.6090    4   0  12         4
                57.36          4.21        1.6062    2   2  14         8
                57.59          1.79        1.6004    1   1  15         8
                57.82          1.75        1.5947    3   7   3         8
                59.12          1.56        1.5626    4   4  10         8
                60.01          1.13        1.5416    2   6  10         8
                60.23          1.16        1.5364    4   6   6         8
                60.50          1.56        1.5304    0   0  16         2
                61.67          1.71        1.5041    1   5  13         8
                63.02          1.63        1.4750    6   2   8         8
                64.79          2.12        1.4390    4   4  12         8
                65.63          1.62        1.4225    2   6  12         8
                65.86          1.42        1.4182    1   1  17         8
                69.47          2.39        1.3531    6   6   0         4
                72.37          1.44        1.3057    3   9   3         8
                72.78          1.32        1.2995    6   4  10         8
                73.76          1.15        1.2846    5   7   7         8
================================================================================
       XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
  For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.