R040017
Tetragonal
1.541838 1.540562 1.544390
 26.6260    1   1   0   2
 33.9167    1   0   1   2
 38.0027    2   0   0   2
 39.0247    1   1   1   2
 42.6794    2   1   0   2
 51.8150    2   1   1   2
 54.8013    2   2   0   2
 57.8612    0   0   2   2
 61.9202    3   1   0   2
 64.7830    1   1   2   2
 66.0048    3   0   1   2
 71.3148    2   0   2   2
 78.7516    3   2   1   2
 81.1795    4   0   0   2
 83.7561    2   2   2   2
 87.2767    3   3   0   2