# generated using pymatgen
data_Ca6Ga6Si3(HO12)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.79294800
_cell_length_b   7.97358576
_cell_length_c   19.56756403
_cell_angle_alpha   97.57856990
_cell_angle_beta   97.52533582
_cell_angle_gamma   109.65262532
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca6Ga6Si3(HO12)2
_chemical_formula_sum   'Ca12 Ga12 Si6 H4 O48'
_cell_volume   1114.85877859
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ca  Ca0  1  0.90132900  0.90186100  0.09612400  1.0
  Ca  Ca1  1  0.48101700  0.47406900  0.23891000  1.0
  Ca  Ca2  1  0.67395800  0.97774500  0.33367200  1.0
  Ca  Ca3  1  0.14535800  0.13261600  0.57327700  1.0
  Ca  Ca4  1  0.33659300  0.64368500  0.66851400  1.0
  Ca  Ca5  1  0.95436900  0.65236100  0.33163200  1.0
  Ca  Ca6  1  0.57372200  0.56041700  0.42904800  1.0
  Ca  Ca7  1  0.80049700  0.80180100  0.90207600  1.0
  Ca  Ca8  1  0.62266600  0.32225200  0.66820500  1.0
  Ca  Ca9  1  0.23610100  0.22752800  0.76346400  1.0
  Ca  Ca10  1  0.99670100  0.28445700  0.99983900  1.0
  Ca  Ca11  1  0.28594200  0.00174900  0.99947500  1.0
  Ga  Ga12  1  0.41622300  0.67182300  0.08186300  1.0
  Ga  Ga13  1  0.00737700  0.25557000  0.24687200  1.0
  Ga  Ga14  1  0.66747400  0.42066400  0.08654900  1.0
  Ga  Ga15  1  0.74351000  0.25076600  0.49884000  1.0
  Ga  Ga16  1  0.41004000  0.91130100  0.83459800  1.0
  Ga  Ga17  1  0.25139100  0.99879200  0.25017600  1.0
  Ga  Ga18  1  0.75375400  0.99983300  0.74946900  1.0
  Ga  Ga19  1  0.58238700  0.08358400  0.16571900  1.0
  Ga  Ga20  1  0.91179400  0.67117900  0.58600400  1.0
  Ga  Ga21  1  0.25898300  0.75030800  0.50009200  1.0
  Ga  Ga22  1  0.57876100  0.33300300  0.91796600  1.0
  Ga  Ga23  1  0.92454000  0.42329700  0.83299800  1.0
  Si  Si24  1  0.08702400  0.58575500  0.16735200  1.0
  Si  Si25  1  0.08460100  0.32805500  0.41714100  1.0
  Si  Si26  1  0.67041200  0.91944100  0.58161200  1.0
  Si  Si27  1  0.31872700  0.07723400  0.41567700  1.0
  Si  Si28  1  0.33292000  0.58077000  0.91632300  1.0
  Si  Si29  1  0.99626500  0.74895300  0.74995800  1.0
  H  H30  1  0.65751300  0.30624000  0.32898700  1.0
  H  H31  1  0.23235900  0.23044900  0.11486800  1.0
  H  H32  1  0.32805600  0.97399400  0.66463200  1.0
  H  H33  1  0.98676500  0.65313400  0.99327500  1.0
  O  O34  1  0.73530100  0.74948300  0.27577700  1.0
  O  O35  1  0.44466000  0.91063400  0.08799700  1.0
  O  O36  1  0.08810900  0.79508700  0.18584900  1.0
  O  O37  1  0.92704700  0.47284100  0.09754300  1.0
  O  O38  1  0.67465300  0.43415700  0.33709300  1.0
  O  O39  1  0.28552200  0.57272200  0.15168300  1.0
  O  O40  1  0.04308100  0.49684000  0.23851500  1.0
  O  O41  1  0.64074300  0.64310500  0.09609300  1.0
  O  O42  1  0.74400600  0.48117800  0.51984300  1.0
  O  O43  1  0.95546900  0.23862700  0.33927700  1.0
  O  O44  1  0.54497000  0.13380800  0.42255200  1.0
  O  O45  1  0.33661700  0.09906900  0.66649200  1.0
  O  O46  1  0.96921700  0.24464500  0.47729900  1.0
  O  O47  1  0.14690500  0.14623200  0.07461600  1.0
  O  O48  1  0.56992800  0.30821200  0.15663000  1.0
  O  O49  1  0.70269800  0.13217900  0.57424800  1.0
  O  O50  1  0.27633500  0.27301200  0.42644000  1.0
  O  O51  1  0.22400500  0.21655500  0.24208500  1.0
  O  O52  1  0.49404300  0.03666000  0.24826000  1.0
  O  O53  1  0.61024700  0.89051100  0.65772900  1.0
  O  O54  1  0.21909100  0.78724000  0.75520300  1.0
  O  O55  1  0.20800800  0.94729000  0.34006300  1.0
  O  O56  1  0.82216400  0.08359400  0.18299000  1.0
  O  O57  1  0.62423600  0.88815800  0.81216700  1.0
  O  O58  1  0.79139000  0.80516100  0.39620900  1.0
  O  O59  1  0.24082000  0.96767100  0.47768100  1.0
  O  O60  1  0.97220200  0.94798000  0.75490000  1.0
  O  O61  1  0.35860700  0.79229400  0.90967500  1.0
  O  O62  1  0.86429400  0.88365100  0.57465600  1.0
  O  O63  1  0.15656500  0.72155500  0.57832200  1.0
  O  O64  1  0.27127400  0.54614400  0.99239800  1.0
  O  O65  1  0.99998900  0.78055900  0.00104100  1.0
  O  O66  1  0.88098300  0.61519500  0.67387100  1.0
  O  O67  1  0.50714200  0.77424100  0.51776600  1.0
  O  O68  1  0.17085600  0.43679200  0.85149700  1.0
  O  O69  1  0.48872400  0.69143300  0.33764700  1.0
  O  O70  1  0.39180100  0.41174100  0.60475400  1.0
  O  O71  1  0.45300700  0.46818300  0.72540800  1.0
  O  O72  1  0.15104700  0.55094600  0.42556500  1.0
  O  O73  1  0.91189500  0.64367800  0.81165800  1.0
  O  O74  1  0.52655500  0.54519200  0.90824300  1.0
  O  O75  1  0.82840800  0.39191400  0.91293300  1.0
  O  O76  1  0.55233300  0.26254100  0.00265800  1.0
  O  O77  1  0.15094000  0.35223600  0.66435400  1.0
  O  O78  1  0.06276100  0.06854400  0.92421700  1.0
  O  O79  1  0.81088900  0.24510000  0.75347200  1.0
  O  O80  1  0.41376900  0.14532800  0.84834400  1.0
  O  O81  1  0.78134800  0.99717300  0.99797000  1.0