Scaling = 1.0
Center origo = True
Ideel structure:
[[ 0.12809  -2.613655  0.309238]
 [ 2.631871  0.12809  -0.007548]
 [ 0.007546 -0.309237 -2.616777]
 [-2.631871 -0.12809   0.007548]
 [-0.007546  0.309237  2.616777]
 [ 1.85568   0.309237  1.845006]
 [ 1.866351 -0.128091 -1.85568 ]
 [-1.85568  -0.309237 -1.845006]
 [-1.866351  0.128091  1.85568 ]
 [-0.12809   2.613655 -0.309238]]
Disordered structure:
[[ 0.00000000e+00 -2.63500000e+00 -2.22044605e-17]
 [ 2.38424900e+00 -1.12194000e+00 -2.22044605e-17]
 [ 0.00000000e+00 -1.12194000e+00 -2.38424900e+00]
 [-2.38424900e+00 -1.12194000e+00 -2.22044605e-17]
 [ 0.00000000e+00 -1.12194000e+00  2.38424900e+00]
 [ 1.68592900e+00  1.12194000e+00  1.68592900e+00]
 [ 1.68592900e+00  1.12194000e+00 -1.68592900e+00]
 [-1.68592900e+00  1.12194000e+00 -1.68592900e+00]
 [-1.68592900e+00  1.12194000e+00  1.68592900e+00]
 [ 0.00000000e+00  2.63500000e+00 -2.22044605e-17]]
Symmetry deviation (sigma) value = 16.13818875791224