# generated using pymatgen
data_Li3Nd2H6(N3O10)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.47833000
_cell_length_b   13.47833000
_cell_length_c   13.47833000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Nd2H6(N3O10)3
_chemical_formula_sum   'Li12 Nd8 H24 N36 O120'
_cell_volume   2448.54593567
_cell_formula_units_Z   4
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
  Li  Li0  1  0.20128700  0.94946300  0.77755400  1
  Li  Li1  1  0.22244600  0.70128700  0.55053700  1
  Li  Li2  1  0.44946300  0.72244600  0.79871300  1
  Li  Li3  1  0.70128700  0.55053700  0.22244600  1
  Li  Li4  1  0.72244600  0.79871300  0.44946300  1
  Li  Li5  1  0.94946300  0.77755400  0.20128700  1
  Li  Li6  1  0.79871300  0.44946300  0.72244600  1
  Li  Li7  1  0.77755400  0.20128700  0.94946300  1
  Li  Li8  1  0.55053700  0.22244600  0.70128700  1
  Li  Li9  1  0.29871300  0.05053700  0.27755400  1
  Li  Li10  1  0.27755400  0.29871300  0.05053700  1
  Li  Li11  1  0.05053700  0.27755400  0.29871300  1
  Nd  Nd12  1  0.03423300  0.53423300  0.96576700  1
  Nd  Nd13  1  0.53423300  0.96576700  0.03423300  1
  Nd  Nd14  1  0.96576700  0.03423300  0.53423300  1
  Nd  Nd15  1  0.46576700  0.46576700  0.46576700  1
  Nd  Nd16  1  0.77855400  0.77855400  0.77855400  1
  Nd  Nd17  1  0.22144600  0.27855400  0.72144600  1
  Nd  Nd18  1  0.27855400  0.72144600  0.22144600  1
  Nd  Nd19  1  0.72144600  0.22144600  0.27855400  1
  H  H20  1  0.86302500  0.48708100  0.53307500  1
  H  H21  1  0.46692500  0.36302500  0.01291900  1
  H  H22  1  0.98708100  0.96692500  0.13697500  1
  H  H23  1  0.36302500  0.01291900  0.46692500  1
  H  H24  1  0.96692500  0.13697500  0.98708100  1
  H  H25  1  0.48708100  0.53307500  0.86302500  1
  H  H26  1  0.13697500  0.98708100  0.96692500  1
  H  H27  1  0.53307500  0.86302500  0.48708100  1
  H  H28  1  0.01291900  0.46692500  0.36302500  1
  H  H29  1  0.63697500  0.51291900  0.03307500  1
  H  H30  1  0.03307500  0.63697500  0.51291900  1
  H  H31  1  0.51291900  0.03307500  0.63697500  1
  H  H32  1  0.05735400  0.94908100  0.89167500  1
  H  H33  1  0.10832500  0.55735400  0.55091900  1
  H  H34  1  0.44908100  0.60832500  0.94264600  1
  H  H35  1  0.55735400  0.55091900  0.10832500  1
  H  H36  1  0.60832500  0.94264600  0.44908100  1
  H  H37  1  0.94908100  0.89167500  0.05735400  1
  H  H38  1  0.94264600  0.44908100  0.60832500  1
  H  H39  1  0.89167500  0.05735400  0.94908100  1
  H  H40  1  0.55091900  0.10832500  0.55735400  1
  H  H41  1  0.44264600  0.05091900  0.39167500  1
  H  H42  1  0.39167500  0.44264600  0.05091900  1
  H  H43  1  0.05091900  0.39167500  0.44264600  1
  N  N44  1  0.23612400  0.62644000  0.01291900  1
  N  N45  1  0.98708100  0.73612400  0.87356000  1
  N  N46  1  0.12644000  0.48708100  0.76387600  1
  N  N47  1  0.73612400  0.87356000  0.98708100  1
  N  N48  1  0.48708100  0.76387600  0.12644000  1
  N  N49  1  0.62644000  0.01291900  0.23612400  1
  N  N50  1  0.76387600  0.12644000  0.48708100  1
  N  N51  1  0.01291900  0.23612400  0.62644000  1
  N  N52  1  0.87356000  0.98708100  0.73612400  1
  N  N53  1  0.26387600  0.37356000  0.51291900  1
  N  N54  1  0.51291900  0.26387600  0.37356000  1
  N  N55  1  0.37356000  0.51291900  0.26387600  1
  N  N56  1  0.38930400  0.60464300  0.62684700  1
  N  N57  1  0.37315300  0.88930400  0.89535700  1
  N  N58  1  0.10464300  0.87315300  0.61069600  1
  N  N59  1  0.88930400  0.89535700  0.37315300  1
  N  N60  1  0.87315300  0.61069600  0.10464300  1
  N  N61  1  0.60464300  0.62684700  0.38930400  1
  N  N62  1  0.61069600  0.10464300  0.87315300  1
  N  N63  1  0.62684700  0.38930400  0.60464300  1
  N  N64  1  0.89535700  0.37315300  0.88930400  1
  N  N65  1  0.11069600  0.39535700  0.12684700  1
  N  N66  1  0.12684700  0.11069600  0.39535700  1
  N  N67  1  0.39535700  0.12684700  0.11069600  1
  N  N68  1  0.70988200  0.58157100  0.85171400  1
  N  N69  1  0.14828600  0.20988200  0.91842900  1
  N  N70  1  0.08157100  0.64828600  0.29011800  1
  N  N71  1  0.20988200  0.91842900  0.14828600  1
  N  N72  1  0.64828600  0.29011800  0.08157100  1
  N  N73  1  0.58157100  0.85171400  0.70988200  1
  N  N74  1  0.29011800  0.08157100  0.64828600  1
  N  N75  1  0.85171400  0.70988200  0.58157100  1
  N  N76  1  0.91842900  0.14828600  0.20988200  1
  N  N77  1  0.79011800  0.41842900  0.35171400  1
  N  N78  1  0.35171400  0.79011800  0.41842900  1
  N  N79  1  0.41842900  0.35171400  0.79011800  1
  O  O80  1  0.87260900  0.92111000  0.66700300  1
  O  O81  1  0.33299700  0.37260900  0.57889000  1
  O  O82  1  0.42111000  0.83299700  0.12739100  1
  O  O83  1  0.37260900  0.57889000  0.33299700  1
  O  O84  1  0.83299700  0.12739100  0.42111000  1
  O  O85  1  0.92111000  0.66700300  0.87260900  1
  O  O86  1  0.12739100  0.42111000  0.83299700  1
  O  O87  1  0.66700300  0.87260900  0.92111000  1
  O  O88  1  0.57889000  0.33299700  0.37260900  1
  O  O89  1  0.62739100  0.07889000  0.16700300  1
  O  O90  1  0.16700300  0.62739100  0.07889000  1
  O  O91  1  0.07889000  0.16700300  0.62739100  1
  O  O92  1  0.22054700  0.58319100  0.93212700  1
  O  O93  1  0.06787300  0.72054700  0.91680900  1
  O  O94  1  0.08319100  0.56787300  0.77945300  1
  O  O95  1  0.72054700  0.91680900  0.06787300  1
  O  O96  1  0.56787300  0.77945300  0.08319100  1
  O  O97  1  0.58319100  0.93212700  0.22054700  1
  O  O98  1  0.77945300  0.08319100  0.56787300  1
  O  O99  1  0.93212700  0.22054700  0.58319100  1
  O  O100  1  0.91680900  0.06787300  0.72054700  1
  O  O101  1  0.27945300  0.41680900  0.43212700  1
  O  O102  1  0.43212700  0.27945300  0.41680900  1
  O  O103  1  0.41680900  0.43212700  0.27945300  1
  O  O104  1  0.83152700  0.96739400  0.81727900  1
  O  O105  1  0.18272100  0.33152700  0.53260600  1
  O  O106  1  0.46739400  0.68272100  0.16847300  1
  O  O107  1  0.33152700  0.53260600  0.18272100  1
  O  O108  1  0.68272100  0.16847300  0.46739400  1
  O  O109  1  0.96739400  0.81727900  0.83152700  1
  O  O110  1  0.16847300  0.46739400  0.68272100  1
  O  O111  1  0.81727900  0.83152700  0.96739400  1
  O  O112  1  0.53260600  0.18272100  0.33152700  1
  O  O113  1  0.66847300  0.03260600  0.31727900  1
  O  O114  1  0.31727900  0.66847300  0.03260600  1
  O  O115  1  0.03260600  0.31727900  0.66847300  1
  O  O116  1  0.34047900  0.59252000  0.54530400  1
  O  O117  1  0.45469600  0.84047900  0.90748000  1
  O  O118  1  0.09252000  0.95469600  0.65952100  1
  O  O119  1  0.84047900  0.90748000  0.45469600  1
  O  O120  1  0.95469600  0.65952100  0.09252000  1
  O  O121  1  0.59252000  0.54530400  0.34047900  1
  O  O122  1  0.65952100  0.09252000  0.95469600  1
  O  O123  1  0.54530400  0.34047900  0.59252000  1
  O  O124  1  0.90748000  0.45469600  0.84047900  1
  O  O125  1  0.15952100  0.40748000  0.04530400  1
  O  O126  1  0.04530400  0.15952100  0.40748000  1
  O  O127  1  0.40748000  0.04530400  0.15952100  1
  O  O128  1  0.05096700  0.85977900  0.53482400  1
  O  O129  1  0.46517600  0.55096700  0.64022100  1
  O  O130  1  0.35977900  0.96517600  0.94903300  1
  O  O131  1  0.55096700  0.64022100  0.46517600  1
  O  O132  1  0.96517600  0.94903300  0.35977900  1
  O  O133  1  0.85977900  0.53482400  0.05096700  1
  O  O134  1  0.94903300  0.35977900  0.96517600  1
  O  O135  1  0.53482400  0.05096700  0.85977900  1
  O  O136  1  0.64022100  0.46517600  0.55096700  1
  O  O137  1  0.44903300  0.14022100  0.03482400  1
  O  O138  1  0.03482400  0.44903300  0.14022100  1
  O  O139  1  0.14022100  0.03482400  0.44903300  1
  O  O140  1  0.36035700  0.66814600  0.68787200  1
  O  O141  1  0.31212800  0.86035700  0.83185400  1
  O  O142  1  0.16814600  0.81212800  0.63964300  1
  O  O143  1  0.86035700  0.83185400  0.31212800  1
  O  O144  1  0.81212800  0.63964300  0.16814600  1
  O  O145  1  0.66814600  0.68787200  0.36035700  1
  O  O146  1  0.63964300  0.16814600  0.81212800  1
  O  O147  1  0.68787200  0.36035700  0.66814600  1
  O  O148  1  0.83185400  0.31212800  0.86035700  1
  O  O149  1  0.13964300  0.33185400  0.18787200  1
  O  O150  1  0.18787200  0.13964300  0.33185400  1
  O  O151  1  0.33185400  0.18787200  0.13964300  1
  O  O152  1  0.70438000  0.66158000  0.90167600  1
  O  O153  1  0.09832400  0.20438000  0.83842000  1
  O  O154  1  0.16158000  0.59832400  0.29562000  1
  O  O155  1  0.20438000  0.83842000  0.09832400  1
  O  O156  1  0.59832400  0.29562000  0.16158000  1
  O  O157  1  0.66158000  0.90167600  0.70438000  1
  O  O158  1  0.29562000  0.16158000  0.59832400  1
  O  O159  1  0.90167600  0.70438000  0.66158000  1
  O  O160  1  0.83842000  0.09832400  0.20438000  1
  O  O161  1  0.79562000  0.33842000  0.40167600  1
  O  O162  1  0.40167600  0.79562000  0.33842000  1
  O  O163  1  0.33842000  0.40167600  0.79562000  1
  O  O164  1  0.74598600  0.58905000  0.76269300  1
  O  O165  1  0.23730700  0.24598600  0.91095000  1
  O  O166  1  0.08905000  0.73730700  0.25401400  1
  O  O167  1  0.24598600  0.91095000  0.23730700  1
  O  O168  1  0.73730700  0.25401400  0.08905000  1
  O  O169  1  0.58905000  0.76269300  0.74598600  1
  O  O170  1  0.25401400  0.08905000  0.73730700  1
  O  O171  1  0.76269300  0.74598600  0.58905000  1
  O  O172  1  0.91095000  0.23730700  0.24598600  1
  O  O173  1  0.75401400  0.41095000  0.26269300  1
  O  O174  1  0.26269300  0.75401400  0.41095000  1
  O  O175  1  0.41095000  0.26269300  0.75401400  1
  O  O176  1  0.50029100  0.88517800  0.68359800  1
  O  O177  1  0.31640200  0.00029100  0.61482200  1
  O  O178  1  0.38517800  0.81640200  0.49970900  1
  O  O179  1  0.00029100  0.61482200  0.31640200  1
  O  O180  1  0.81640200  0.49970900  0.38517800  1
  O  O181  1  0.88517800  0.68359800  0.50029100  1
  O  O182  1  0.49970900  0.38517800  0.81640200  1
  O  O183  1  0.68359800  0.50029100  0.88517800  1
  O  O184  1  0.61482200  0.31640200  0.00029100  1
  O  O185  1  0.99970900  0.11482200  0.18359800  1
  O  O186  1  0.18359800  0.99970900  0.11482200  1
  O  O187  1  0.11482200  0.18359800  0.99970900  1
  O  O188  1  0.10403700  0.62117400  0.51701800  1
  O  O189  1  0.48298200  0.60403700  0.87882600  1
  O  O190  1  0.12117400  0.98298200  0.89596300  1
  O  O191  1  0.60403700  0.87882600  0.48298200  1
  O  O192  1  0.98298200  0.89596300  0.12117400  1
  O  O193  1  0.62117400  0.51701800  0.10403700  1
  O  O194  1  0.89596300  0.12117400  0.98298200  1
  O  O195  1  0.51701800  0.10403700  0.62117400  1
  O  O196  1  0.87882600  0.48298200  0.60403700  1
  O  O197  1  0.39596300  0.37882600  0.01701800  1
  O  O198  1  0.01701800  0.39596300  0.37882600  1
  O  O199  1  0.37882600  0.01701800  0.39596300  1
