element(s): ['Al', 'Ca', 'O', 'Si'] AFLOW prototype label: A2B3C12D3_cI160_230_a_c_h_d Parameter names: ['a', 'x4', 'y4', 'z4'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['11.9655', '0.46199801', '0.955258', '0.15124291'] model name: Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Al', 'Ca', 'O', 'Si'] representative atom coordinates = [[0. 0. 0. ] [0.125 0. 0.25 ] [0.96199801 0.455258 0.65124291] [0.375 0. 0.25 ]] spacegroup = 230 cell = [[11.9655, 0, 0], [0, 11.9655, 0], [0, 0, 11.9655]] =========================================