element(s):
['S']
AFLOW prototype label:
A_mP28_14_7e
Parameter names:
['a', 'b/a', 'c/a', 'beta', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4', 'x5', 'y5', 'z5', 'x6', 'y6', 'z6', 'x7', 'y7', 'z7']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['10.8037', '0.77601192', '0.96535446', '97.3409', '0.37273041', '0.1912782', '0.55547686', '0.44767069', '0.37878627', '0.66514659', '0.22341489', '0.11024227', '0.63961418', '0.31827724', '0.56674086', '0.6096735', '0.084837467', '0.28772778', '0.58497939', '0.22067413', '0.60142018', '0.75529584', '0.069101214', '0.41862764', '0.73995732']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['S', 'S', 'S', 'S', 'S', 'S', 'S']
representative atom coordinates =  [[0.62726959 0.1912782  0.07179273]
 [0.55232931 0.37878627 0.88718272]
 [0.77658511 0.11024227 0.13697093]
 [0.68172276 0.56674086 0.07204926]
 [0.91516253 0.28772778 0.33018314]
 [0.77932587 0.60142018 0.02403003]
 [0.93089879 0.41862764 0.19094147]]
spacegroup =  14
cell =  [[15.9464, 0, 0], [0, 8.3838, 0], [-7.7239828817714, 0, 7.0080291667559]]
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