# generated using pymatgen
data_Cr2Co3H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37443521
_cell_length_b   9.72887922
_cell_length_c   13.68827072
_cell_angle_alpha   103.41962285
_cell_angle_beta   90.00000852
_cell_angle_gamma   90.00012717
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2Co3H32C12(NO2)6
_chemical_formula_sum   'Cr4 Co6 H64 C24 N12 O24'
_cell_volume   1214.32193834
_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
  Cr  Cr0  1  0.09626052  0.85183067  0.72750678  1
  Cr  Cr1  1  0.59626553  0.64818971  0.77252521  1
  Cr  Cr2  1  0.90373491  0.14819315  0.27252421  1
  Cr  Cr3  1  0.40373708  0.35183600  0.22750811  1
  Co  Co4  1  0.93939344  0.55456820  0.73117885  1
  Co  Co5  1  0.43940698  0.94543212  0.76883232  1
  Co  Co6  1  0.06058146  0.44543301  0.26881829  1
  Co  Co7  1  0.56060175  0.05457468  0.23118388  1
  Co  Co8  1  -0.00006605  1.00005646  1.00011922  1
  Co  Co9  1  0.50003850  0.50003154  0.50013760  1
  H  H10  1  0.19019916  0.18679350  0.08568451  1
  H  H11  1  0.69017433  0.31322212  0.41431444  1
  H  H12  1  0.80982332  0.81322045  0.91431838  1
  H  H13  1  0.30980236  0.68679698  0.58568388  1
  H  H14  1  0.27515941  0.09189071  0.98519854  1
  H  H15  1  0.77518361  0.40808287  0.51480590  1
  H  H16  1  0.72481376  0.90808092  0.01480983  1
  H  H17  1  0.22484018  0.59189049  0.48520192  1
  H  H18  1  0.58143781  0.37449709  0.86694185  1
  H  H19  1  0.08144383  0.12550089  0.63305719  1
  H  H20  1  0.41856083  0.62550666  0.13305660  1
  H  H21  1  0.91855970  0.87450481  0.36694069  1
  H  H22  1  0.47585384  0.15996154  0.88342676  1
  H  H23  1  -0.02414162  0.34003499  0.61657743  1
  H  H24  1  0.52413854  0.84004792  0.11657693  1
  H  H25  1  1.02414231  0.65995913  0.38341504  1
  H  H26  1  0.76537898  0.02789776  0.85302513  1
  H  H27  1  0.26538585  0.47209338  0.64695595  1
  H  H28  1  0.23461669  0.97209727  0.14695300  1
  H  H29  1  0.73463105  0.52789754  0.35302255  1
  H  H30  1  0.91832456  0.09332041  0.80305416  1
  H  H31  1  0.41833399  0.40667361  0.69692072  1
  H  H32  1  0.08167164  0.90667847  0.19691990  1
  H  H33  1  0.58168758  0.59330821  0.30304659  1
  H  H34  1  0.20745612  0.32770990  0.96922093  1
  H  H35  1  0.70745273  0.17228086  0.53077545  1
  H  H36  1  0.79255021  0.67228061  0.03077791  1
  H  H37  1  0.29254859  0.82770891  0.46922262  1
  H  H38  1  0.16534818  0.18062801  0.87116896  1
  H  H39  1  0.66534648  0.31935186  0.62883172  1
  H  H40  1  0.83465350  0.81935433  0.12883325  1
  H  H41  1  0.33463561  0.68062649  0.37116914  1
  H  H42  1  0.58135206  0.36616289  0.04182661  1
  H  H43  1  0.08134165  0.13382558  0.45816724  1
  H  H44  1  0.41865864  0.63382887  0.95816739  1
  H  H45  1  0.91864578  0.86616243  0.54182282  1
  H  H46  1  0.73824899  0.43878846  0.00381991  1
  H  H47  1  0.23824344  0.06120309  0.49617331  1
  H  H48  1  0.26175938  0.56120398  0.99617412  1
  H  H49  1  0.76174900  0.93878999  0.50381817  1
  H  H50  1  0.79577972  0.26867615  0.10357138  1
  H  H51  1  0.29576119  0.23130837  0.39640991  1
  H  H52  1  0.20423614  0.73130731  0.89640995  1
  H  H53  1  0.70421636  0.76867136  0.60356548  1
  H  H54  1  0.69364361  0.13402999  0.02604564  1
  H  H55  1  0.19363556  0.36596245  0.47394273  1
  H  H56  1  0.30636350  0.86596284  0.97394050  1
  H  H57  1  0.80635810  0.63402938  0.52604046  1
  H  H58  1  0.81022018  0.31898662  0.80381317  1
  H  H59  1  0.31022829  0.18101087  0.69617660  1
  H  H60  1  0.18977951  0.68102079  0.19618164  1
  H  H61  1  0.68978102  0.81897722  0.30380302  1
  H  H62  1  0.69261610  0.18083016  0.74746325  1
  H  H63  1  0.19263029  0.31917233  0.75252590  1
  H  H64  1  0.30737953  0.81918478  0.25252465  1
  H  H65  1  0.80739448  0.68082694  0.24745932  1
  H  H66  1  0.98059829  0.41500087  0.10667761  1
  H  H67  1  0.48059826  0.08498066  0.39332334  1
  H  H68  1  0.01940377  0.58497086  0.89331949  1
  H  H69  1  0.51940307  0.91502390  0.60668571  1
  H  H70  1  0.96421912  0.37369912  0.93366815  1
  H  H71  1  0.46421414  0.12629255  0.56632092  1
  H  H72  1  0.03578474  0.62629321  0.06632046  1
  H  H73  1  0.53577566  0.87369301  0.43366262  1
  C  C74  1  0.82839108  0.12312576  0.85429359  1
  C  C75  1  0.32839916  0.37686589  0.64568367  1
  C  C76  1  0.17160500  0.87686913  0.14568237  1
  C  C77  1  0.67161609  0.62312319  0.35428939  1
  C  C78  1  0.14033946  0.23222166  0.94994182  1
  C  C79  1  0.64033559  0.26776775  0.55005917  1
  C  C80  1  0.85966587  0.76776943  0.05006167  1
  C  C81  1  0.35966154  0.73221719  0.44993852  1
  C  C82  1  0.67491951  0.34032848  0.99265306  1
  C  C83  1  0.17491257  0.15966184  0.50733826  1
  C  C84  1  0.32508850  0.65966396  0.00733828  1
  C  C85  1  0.82507823  0.84032967  0.49264956  1
  C  C86  1  0.75939444  0.22690224  0.02657075  1
  C  C87  1  0.25938261  0.27308647  0.47341185  1
  C  C88  1  0.24061684  0.77308667  0.97341142  1
  C  C89  1  0.74060515  0.72690043  0.52656549  1
  C  C90  1  0.74099298  0.23423520  0.81924732  1
  C  C91  1  0.24100192  0.26576187  0.68074139  1
  C  C92  1  0.25900465  0.76576955  0.18074223  1
  C  C93  1  0.75901257  0.73423239  0.31924168  1
  C  C94  1  0.99068824  0.27769161  0.96058650  1
  C  C95  1  0.49068602  0.22229169  0.53939290  1
  C  C96  1  0.00931611  0.72229388  0.03939345  1
  C  C97  1  0.50931200  0.77768807  0.46058463  1
  N  N98  1  0.88271450  0.17647912  0.95893078  1
  N  N99  1  0.38271141  0.32350501  0.54104314  1
  N  N100  1  0.11729078  0.82350578  0.04104298  1
  N  N101  1  0.61728758  0.67647512  0.45892574  1
  N  N102  1  0.17701862  0.13232064  0.01210377  1
  N  N103  1  0.67703269  0.36767538  0.48790440  1
  N  N104  1  0.82296561  0.86767519  0.98790621  1
  N  N105  1  0.32298084  0.63231980  0.51210370  1
  N  N106  1  0.62750920  0.29085995  0.88956443  1
  N  N107  1  0.12751201  0.20913444  0.61042961  1
  N  N108  1  0.37249132  0.70913911  0.11042897  1
  N  N109  1  0.87249094  0.79086483  0.38956125  1
  O  O110  1  0.05309762  0.89696533  0.84932308  1
  O  O111  1  0.55305053  0.60308954  0.65068941  1
  O  O112  1  0.94695951  0.10307936  0.15069152  1
  O  O113  1  0.44690305  0.39697342  0.34932284  1
  O  O114  1  0.02979023  0.96684531  0.66818068  1
  O  O115  1  0.52979769  0.53316556  0.83184601  1
  O  O116  1  0.97019863  0.03317739  0.33185392  1
  O  O117  1  0.47021380  0.46684877  0.16818261  1
  O  O118  1  0.89410518  0.40730052  0.62638240  1
  O  O119  1  0.39409769  0.09269872  0.87362247  1
  O  O120  1  0.10590114  0.59269926  0.37360497  1
  O  O121  1  0.60589109  0.90731479  0.12638230  1
  O  O122  1  0.03276996  0.68811154  0.67131614  1
  O  O123  1  0.53278255  0.81191451  0.82872445  1
  O  O124  1  0.96721802  0.31192020  0.32871793  1
  O  O125  1  0.46722429  0.18811615  0.17131976  1
  O  O126  1  0.27760478  0.83960746  0.71057393  1
  O  O127  1  0.77760364  0.66040181  0.78943866  1
  O  O128  1  0.72239691  0.16040962  0.28943464  1
  O  O129  1  0.22239324  0.33961377  0.21057037  1
  O  O130  1  0.03569321  0.50460926  0.83602555  1
  O  O131  1  0.53567769  0.99539148  0.66397679  1
  O  O132  1  0.96430063  0.49538017  0.16395929  1
  O  O133  1  0.46430469  0.00461478  0.33603191  1
