data_[Sr6Pr14Cr18Ni2O60]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pr  1.1300  1.8500  1.0600
  Cr  1.6600  1.4000  0.9400
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.5161]
_cell_length_b [5.5629]
_cell_length_c [39.1535]
_cell_angle_alpha [90.0353]
_cell_angle_beta [90.1234]
_cell_angle_gamma [90.3038]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Sr3Pr7Cr9NiO30]
_chemical_formula_sum '[Sr6 Pr14 Cr18 Ni2 O60]'
_cell_volume [1201.4357]
_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
[
  Sr  Sr0  1  0.4963  0.4763  0.8504  1
  Sr  Sr1  1  0.9930  0.0295  0.5504  1
  Sr  Sr2  1  0.9940  0.0285  0.1506  1
  Sr  Sr3  1  0.9941  0.0259  0.9501  1
  Sr  Sr4  1  0.9948  0.0292  0.3502  1
  Sr  Sr5  1  0.9952  0.0259  0.7508  1
  Pr  Pr6  1  0.0073  0.9587  0.2496  1
  Pr  Pr7  1  0.0088  0.9579  0.4492  1
  Pr  Pr8  1  0.0093  0.9607  0.8503  1
  Pr  Pr9  1  0.0095  0.9585  0.0493  1
  Pr  Pr10  1  0.0100  0.9579  0.6491  1
  Pr  Pr11  1  0.4925  0.4595  0.2494  1
  Pr  Pr12  1  0.4929  0.4597  0.4492  1
  Pr  Pr13  1  0.4943  0.4632  0.6493  1
  Pr  Pr14  1  0.4946  0.4642  0.0491  1
  Pr  Pr15  1  0.5092  0.5391  0.9501  1
  Pr  Pr16  1  0.5096  0.5403  0.7509  1
  Pr  Pr17  1  0.5101  0.5435  0.1507  1
  Pr  Pr18  1  0.5102  0.5395  0.5506  1
  Pr  Pr19  1  0.5107  0.5434  0.3504  1
  Cr  Cr20  1  0.0007  0.4967  0.8004  1
  Cr  Cr21  1  0.0008  0.4969  0.5000  1
  Cr  Cr22  1  0.0018  0.4967  0.9002  1
  Cr  Cr23  1  0.4998  0.0033  0.9002  1
  Cr  Cr24  1  0.5003  0.0034  0.8004  1
  Cr  Cr25  1  0.5007  0.0006  0.5997  1
  Cr  Cr26  1  0.5008  0.0027  0.1005  1
  Cr  Cr27  1  0.5014  0.0013  0.9999  1
  Cr  Cr28  1  0.5017  0.0012  0.3002  1
  Cr  Cr29  1  0.5022  0.0017  0.7003  1
  Cr  Cr30  1  0.5037  0.0009  0.4999  1
  Cr  Cr31  1  0.9977  0.4977  0.3998  1
  Cr  Cr32  1  0.9980  0.4980  0.2000  1
  Cr  Cr33  1  0.9989  0.4974  0.7003  1
  Cr  Cr34  1  0.9990  0.4968  0.9998  1
  Cr  Cr35  1  0.9992  0.4978  0.1003  1
  Cr  Cr36  1  0.9995  0.4971  0.3002  1
  Cr  Cr37  1  0.9996  0.4971  0.5997  1
  Ni  Ni38  1  0.5001  0.0008  0.3996  1
  Ni  Ni39  1  0.5003  0.0009  0.1999  1
  O  O40  1  0.0752  0.4906  0.7508  1
  O  O41  1  0.0782  0.4909  0.9498  1
  O  O42  1  0.0804  0.4917  0.1505  1
  O  O43  1  0.0817  0.4907  0.5496  1
  O  O44  1  0.0819  0.4904  0.3502  1
  O  O45  1  0.2058  0.2254  0.4087  1
  O  O46  1  0.2058  0.2256  0.2088  1
  O  O47  1  0.2081  0.2169  0.8072  1
  O  O48  1  0.2167  0.2150  0.6093  1
  O  O49  1  0.2173  0.2159  0.0093  1
  O  O50  1  0.2194  0.2161  0.2905  1
  O  O51  1  0.2197  0.2110  0.8920  1
  O  O52  1  0.2214  0.2166  0.0908  1
  O  O53  1  0.2222  0.2143  0.6912  1
  O  O54  1  0.2227  0.2145  0.4904  1
  O  O55  1  0.2698  0.7225  0.8067  1
  O  O56  1  0.2744  0.7072  0.4081  1
  O  O57  1  0.2747  0.7077  0.2084  1
  O  O58  1  0.2791  0.7294  0.8931  1
  O  O59  1  0.2834  0.7170  0.0089  1
  O  O60  1  0.2848  0.7157  0.6087  1
  O  O61  1  0.2861  0.7198  0.6917  1
  O  O62  1  0.2874  0.7203  0.4908  1
  O  O63  1  0.2876  0.7226  0.0915  1
  O  O64  1  0.2879  0.7216  0.2913  1
  O  O65  1  0.4372  0.9797  0.5484  1
  O  O66  1  0.4406  0.9794  0.9491  1
  O  O67  1  0.4410  0.9795  0.7490  1
  O  O68  1  0.4416  0.9780  0.1479  1
  O  O69  1  0.4420  0.9794  0.3477  1
  O  O70  1  0.5739  0.0176  0.2520  1
  O  O71  1  0.5748  0.0103  0.8506  1
  O  O72  1  0.5750  0.0187  0.4517  1
  O  O73  1  0.5756  0.0172  0.0511  1
  O  O74  1  0.5776  0.0189  0.6508  1
  O  O75  1  0.7006  0.2881  0.1070  1
  O  O76  1  0.7009  0.2882  0.3070  1
  O  O77  1  0.7019  0.2897  0.7071  1
  O  O78  1  0.7020  0.2889  0.5067  1
  O  O79  1  0.7032  0.2945  0.9932  1
  O  O80  1  0.7037  0.2937  0.5927  1
  O  O81  1  0.7078  0.2815  0.9072  1
  O  O82  1  0.7170  0.2990  0.1935  1
  O  O83  1  0.7172  0.2995  0.3930  1
  O  O84  1  0.7194  0.2890  0.7923  1
  O  O85  1  0.7692  0.7775  0.9063  1
  O  O86  1  0.7729  0.7812  0.7067  1
  O  O87  1  0.7742  0.7815  0.5066  1
  O  O88  1  0.7748  0.7805  0.1070  1
  O  O89  1  0.7777  0.7800  0.3069  1
  O  O90  1  0.7782  0.7721  0.7936  1
  O  O91  1  0.7796  0.7804  0.9940  1
  O  O92  1  0.7802  0.7807  0.5934  1
  O  O93  1  0.7907  0.7701  0.1943  1
  O  O94  1  0.7917  0.7714  0.3940  1
  O  O95  1  0.9235  0.5150  0.4499  1
  O  O96  1  0.9238  0.5140  0.2502  1
  O  O97  1  0.9259  0.5143  0.6503  1
  O  O98  1  0.9265  0.5135  0.0504  1
  O  O99  1  0.9442  0.5172  0.8488  1
]