#======================================================================

# CRYSTAL DATA

#----------------------------------------------------------------------

data_VESTA_phase_1


_chemical_name_common                  'image0                                '
_cell_length_a                         10.14988
_cell_length_b                         10.14988
_cell_length_c                         38.07480
_cell_angle_alpha                      90
_cell_angle_beta                       90
_cell_angle_gamma                      120
_space_group_name_H-M_alt              'P 1'
_space_group_IT_number                 1

loop_
_space_group_symop_operation_xyz
   'x, y, z'

loop_
   _atom_site_label
   _atom_site_occupancy
   _atom_site_fract_x
   _atom_site_fract_y
   _atom_site_fract_z
   _atom_site_adp_type
   _atom_site_B_iso_or_equiv
   _atom_site_type_symbol
   Fe1        1.0     0.001713      0.499910      0.448192     Biso  1.000000 Fe
   Fe2        1.0     0.000803      0.999121      0.448326     Biso  1.000000 Fe
   Fe3        1.0     0.500171      0.499829      0.448969     Biso  1.000000 Fe
   Fe4        1.0     0.500954      0.000591      0.448712     Biso  1.000000 Fe
   Fe5        1.0     0.499446      0.000250      0.552099     Biso  1.000000 Fe
   Fe6        1.0     0.499567      0.499824      0.551617     Biso  1.000000 Fe
   Fe7        1.0     0.999615      0.000272      0.551922     Biso  1.000000 Fe
   Fe8        1.0     0.999396      0.500687      0.551487     Biso  1.000000 Fe
   Fe9        1.0     0.003407      0.496474      0.372645     Biso  1.000000 Fe
   Fe10       1.0     0.000289      0.996119      0.373603     Biso  1.000000 Fe
   Fe11       1.0     0.496605      0.491814      0.375093     Biso  1.000000 Fe
   Fe12       1.0     0.502843      0.999162      0.373831     Biso  1.000000 Fe
   Fe13       1.0     0.501076      0.000990      0.626852     Biso  1.000000 Fe
   Fe14       1.0     0.503506      0.510124      0.626038     Biso  1.000000 Fe
   Fe15       1.0     0.997953      0.002715      0.626986     Biso  1.000000 Fe
   Fe16       1.0     0.996911      0.503626      0.626115     Biso  1.000000 Fe
   Fe17       1.0     0.333045      0.166917      0.569019     Biso  1.000000 Fe
   Fe18       1.0     0.333685      0.668844      0.568960     Biso  1.000000 Fe
   Fe19       1.0     0.829929      0.165926      0.568409     Biso  1.000000 Fe
   Fe20       1.0     0.832087      0.668760      0.568942     Biso  1.000000 Fe
   Fe21       1.0     0.331482      0.153634      0.667175     Biso  1.000000 Fe
   Fe22       1.0     0.321930      0.666512      0.665674     Biso  1.000000 Fe
   Fe23       1.0     0.833165      0.173170      0.666205     Biso  1.000000 Fe
   Fe24       1.0     0.830331      0.668632      0.665826     Biso  1.000000 Fe
   Fe25       1.0     0.333180      0.166553      0.491573     Biso  1.000000 Fe
   Fe26       1.0     0.333110      0.666366      0.491628     Biso  1.000000 Fe
   Fe27       1.0     0.833953      0.166649      0.491509     Biso  1.000000 Fe
   Fe28       1.0     0.834246      0.667069      0.491569     Biso  1.000000 Fe
   Fe29       1.0     0.332324      0.161049      0.383369     Biso  1.000000 Fe
   Fe30       1.0     0.334945      0.664637      0.382736     Biso  1.000000 Fe
   Fe31       1.0     0.837510      0.166940      0.381697     Biso  1.000000 Fe
   Fe32       1.0     0.843696      0.666519      0.385049     Biso  1.000000 Fe
   Fe33       1.0     0.173932      0.330693      0.334004     Biso  1.000000 Fe
   Fe34       1.0     0.171633      0.831597      0.334037     Biso  1.000000 Fe
   Fe35       1.0     0.666396      0.330488      0.335635     Biso  1.000000 Fe
   Fe36       1.0     0.668302      0.845295      0.332552     Biso  1.000000 Fe
   Fe37       1.0     0.166649      0.331114      0.431324     Biso  1.000000 Fe
   Fe38       1.0     0.171241      0.833062      0.431389     Biso  1.000000 Fe
   Fe39       1.0     0.670019      0.333370      0.431283     Biso  1.000000 Fe
   Fe40       1.0     0.667248      0.834051      0.431339     Biso  1.000000 Fe
   Fe41       1.0     0.157134      0.333192      0.614441     Biso  1.000000 Fe
   Fe42       1.0     0.164325      0.834175      0.616853     Biso  1.000000 Fe
   Fe43       1.0     0.664775      0.334792      0.617296     Biso  1.000000 Fe
   Fe44       1.0     0.667754      0.838839      0.617974     Biso  1.000000 Fe
   Fe45       1.0     0.166647      0.333317      0.508787     Biso  1.000000 Fe
   Fe46       1.0     0.166647      0.833317      0.508787     Biso  1.000000 Fe
   Fe47       1.0     0.666647      0.333317      0.508787     Biso  1.000000 Fe
   Fe48       1.0     0.666647      0.833317      0.508787     Biso  1.000000 Fe
   O1         1.0     0.156893     -0.000065      0.410271     Biso  1.000000 O
   O2         1.0     0.157972      0.501081      0.409974     Biso  1.000000 O
   O3         1.0     0.659257      0.004437      0.409249     Biso  1.000000 O
   O4         1.0     0.659070      0.502507      0.408913     Biso  1.000000 O
   O5         1.0     0.342299      0.497852      0.590740     Biso  1.000000 O
   O6         1.0     0.343516      0.997256      0.590523     Biso  1.000000 O
   O7         1.0     0.841524      0.499079      0.589951     Biso  1.000000 O
   O8         1.0     0.842573      0.998589      0.590075     Biso  1.000000 O
   O9         1.0     0.501478      0.155364      0.409203     Biso  1.000000 O
   O10        1.0     0.502227      0.653540      0.408605     Biso  1.000000 O
   O11        1.0     0.997159      0.150672      0.409635     Biso  1.000000 O
   O12        1.0     0.000224      0.650714      0.410378     Biso  1.000000 O
   O13        1.0     0.999240      0.348344      0.589238     Biso  1.000000 O
   O14        1.0     0.002285      0.849013      0.590425     Biso  1.000000 O
   O15        1.0     0.497624      0.347038      0.591757     Biso  1.000000 O
   O16        1.0     0.502890      0.847431      0.590937     Biso  1.000000 O
   O17        1.0     0.348768      0.341203      0.410364     Biso  1.000000 O
   O18        1.0     0.351074      0.845184      0.409722     Biso  1.000000 O
   O19        1.0     0.847620      0.343392      0.408221     Biso  1.000000 O
   O20        1.0     0.844903      0.840338      0.409268     Biso  1.000000 O
   O21        1.0     0.154253      0.159109      0.590758     Biso  1.000000 O
   O22        1.0     0.152431      0.657346      0.590481     Biso  1.000000 O
   O23        1.0     0.650687      0.156002      0.590311     Biso  1.000000 O
   O24        1.0     0.651065      0.659013      0.590493     Biso  1.000000 O
   O25        1.0     0.485500      0.165397      0.529962     Biso  1.000000 O
   O26        1.0     0.485500      0.665397      0.529962     Biso  1.000000 O
   O27        1.0     0.985500      0.165397      0.529962     Biso  1.000000 O
   O28        1.0     0.985500      0.665397      0.529962     Biso  1.000000 O
   O29        1.0     0.174585      0.159648      0.351588     Biso  1.000000 O
   O30        1.0     0.177087      0.662582      0.351466     Biso  1.000000 O
   O31        1.0     0.674667      0.160101      0.347817     Biso  1.000000 O
   O32        1.0     0.676395      0.662146      0.347219     Biso  1.000000 O
   O33        1.0     0.334671      0.320202      0.529937     Biso  1.000000 O
   O34        1.0     0.334671      0.820202      0.529937     Biso  1.000000 O
   O35        1.0     0.834671      0.320202      0.529937     Biso  1.000000 O
   O36        1.0     0.834671      0.820202      0.529937     Biso  1.000000 O
   O37        1.0     0.339090      0.007604      0.351285     Biso  1.000000 O
   O38        1.0     0.340023      0.507231      0.351310     Biso  1.000000 O
   O39        1.0     0.839629      0.009949      0.350086     Biso  1.000000 O
   O40        1.0     0.836836      0.508678      0.349297     Biso  1.000000 O
   O41        1.0     0.179875      0.014546      0.529943     Biso  1.000000 O
   O42        1.0     0.179875      0.514546      0.529943     Biso  1.000000 O
   O43        1.0     0.679875      0.014546      0.529943     Biso  1.000000 O
   O44        1.0     0.679875      0.514546      0.529943     Biso  1.000000 O
   O45        1.0     0.492205      0.327959      0.349424     Biso  1.000000 O
   O46        1.0     0.491556      0.827969      0.349594     Biso  1.000000 O
   O47        1.0     0.997195      0.326534      0.348693     Biso  1.000000 O
   O48        1.0     0.994639      0.824170      0.350542     Biso  1.000000 O
   O49        1.0     0.322598      0.336937      0.652337     Biso  1.000000 O
   O50        1.0     0.326102      0.838275      0.650245     Biso  1.000000 O
   O51        1.0     0.825624      0.339481      0.648249     Biso  1.000000 O
   O52        1.0     0.824916      0.838625      0.649642     Biso  1.000000 O
   O53        1.0     0.014500      0.334603      0.470038     Biso  1.000000 O
   O54        1.0     0.014500      0.834603      0.470038     Biso  1.000000 O
   O55        1.0     0.514500      0.334603      0.470038     Biso  1.000000 O
   O56        1.0     0.514500      0.834603      0.470038     Biso  1.000000 O
   O57        1.0     0.161159      0.489542      0.649242     Biso  1.000000 O
   O58        1.0     0.160739      0.989401      0.649360     Biso  1.000000 O
   O59        1.0     0.660078      0.493175      0.649269     Biso  1.000000 O
   O60        1.0     0.665185      0.995798      0.650600     Biso  1.000000 O
   O61        1.0     0.165329      0.179798      0.470063     Biso  1.000000 O
   O62        1.0     0.165329      0.679798      0.470063     Biso  1.000000 O
   O63        1.0     0.665329      0.179798      0.470063     Biso  1.000000 O
   O64        1.0     0.665329      0.679798      0.470063     Biso  1.000000 O
   O65        1.0     0.007627      0.177499      0.649453     Biso  1.000000 O
   O66        1.0     0.005834      0.673804      0.649641     Biso  1.000000 O
   O67        1.0     0.508191      0.171554      0.650185     Biso  1.000000 O
   O68        1.0     0.499557      0.672260      0.652058     Biso  1.000000 O
   O69        1.0     0.320125      0.485454      0.470057     Biso  1.000000 O
   O70        1.0     0.320125      0.985454      0.470057     Biso  1.000000 O
   O71        1.0     0.820125      0.485454      0.470057     Biso  1.000000 O
   O72        1.0     0.820125      0.985454      0.470057     Biso  1.000000 O
   O73        1.0     0.307171      0.183426      0.714426     Biso  1.000000 O
   O74        1.0     0.227821      0.629534      0.720640     Biso  1.000000 O
   O75        1.0     0.835379      0.208327      0.715254     Biso  1.000000 O
   O76        1.0     0.814476      0.661545      0.715181     Biso  1.000000 O
   O77        1.0     0.227406      0.329730      0.285737     Biso  1.000000 O
   O78        1.0     0.203229      0.829356      0.285770     Biso  1.000000 O
   O79        1.0     0.650291      0.360543      0.278757     Biso  1.000000 O
   O80        1.0     0.701451      0.821940      0.285487     Biso  1.000000 O
   O81        1.0     0.063357      0.444896      0.807580     Biso  1.000000 O
   O82        1.0     0.479193      0.336084      0.193259     Biso  1.000000 O
   C1         1.0     0.308284      0.175531      0.751703     Biso  1.000000 C
   C2         1.0     0.315424      0.679292      0.754860     Biso  1.000000 C
   C3         1.0     0.810006      0.177283      0.751804     Biso  1.000000 C
   C4         1.0     0.809053      0.675415      0.752263     Biso  1.000000 C
   C5         1.0     0.310739      0.425194      0.761791     Biso  1.000000 C
   C6         1.0     0.310780      0.926982      0.759304     Biso  1.000000 C
   C7         1.0     0.809486      0.425111      0.759655     Biso  1.000000 C
   C8         1.0     0.809290      0.926390      0.760717     Biso  1.000000 C
   C9         1.0     0.057895      0.173487      0.761383     Biso  1.000000 C
   C10        1.0     0.058992      0.679240      0.758314     Biso  1.000000 C
   C11        1.0     0.557608      0.174157      0.759266     Biso  1.000000 C
   C12        1.0     0.559226      0.674862      0.761349     Biso  1.000000 C
   C13        1.0     0.062383      0.427960      0.768901     Biso  1.000000 C
   C14        1.0     0.057006      0.926727      0.761057     Biso  1.000000 C
   C15        1.0     0.558323      0.425760      0.761312     Biso  1.000000 C
   C16        1.0     0.559668      0.928101      0.758687     Biso  1.000000 C
   C17        1.0     0.393178      0.089534      0.759410     Biso  1.000000 C
   C18        1.0     0.396163      0.591421      0.761307     Biso  1.000000 C
   C19        1.0     0.892904      0.089804      0.760711     Biso  1.000000 C
   C20        1.0     0.896126      0.591745      0.758962     Biso  1.000000 C
   C21        1.0     0.137701      0.089178      0.760794     Biso  1.000000 C
   C22        1.0     0.145196      0.595146      0.754178     Biso  1.000000 C
   C23        1.0     0.638188      0.090739      0.758253     Biso  1.000000 C
   C24        1.0     0.639508      0.590390      0.761362     Biso  1.000000 C
   C25        1.0     0.144598      0.339420      0.761406     Biso  1.000000 C
   C26        1.0     0.140930      0.841763      0.759476     Biso  1.000000 C
   C27        1.0     0.642051      0.342204      0.759559     Biso  1.000000 C
   C28        1.0     0.642246      0.842359      0.759628     Biso  1.000000 C
   C29        1.0     0.118633      0.410821      0.241234     Biso  1.000000 C
   C30        1.0     0.118207      0.909922      0.239066     Biso  1.000000 C
   C31        1.0     0.621509      0.410230      0.245112     Biso  1.000000 C
   C32        1.0     0.619548      0.911960      0.239685     Biso  1.000000 C
   C33        1.0     0.368457      0.153949      0.239729     Biso  1.000000 C
   C34        1.0     0.370984      0.659618      0.241054     Biso  1.000000 C
   C35        1.0     0.871371      0.159589      0.240215     Biso  1.000000 C
   C36        1.0     0.870201      0.659657      0.240572     Biso  1.000000 C
   C37        1.0     0.373141      0.413866      0.239625     Biso  1.000000 C
   C38        1.0     0.375085      0.910731      0.240103     Biso  1.000000 C
   C39        1.0     0.875823      0.411058      0.240595     Biso  1.000000 C
   C40        1.0     0.875226      0.912082      0.239177     Biso  1.000000 C
   C41        1.0     0.202487      0.074038      0.238908     Biso  1.000000 C
   C42        1.0     0.202370      0.575421      0.241005     Biso  1.000000 C
   C43        1.0     0.703920      0.076537      0.239190     Biso  1.000000 C
   C44        1.0     0.707149      0.580701      0.240702     Biso  1.000000 C
   C45        1.0     0.204958      0.326414      0.248837     Biso  1.000000 C
   C46        1.0     0.203911      0.826048      0.248719     Biso  1.000000 C
   C47        1.0     0.706956      0.323721      0.245417     Biso  1.000000 C
   C48        1.0     0.704827      0.827417      0.248119     Biso  1.000000 C
   C49        1.0     0.454746      0.074697      0.239325     Biso  1.000000 C
   C50        1.0     0.453821      0.575343      0.240306     Biso  1.000000 C
   C51        1.0     0.955703      0.076253      0.239292     Biso  1.000000 C
   C52        1.0     0.954913      0.575089      0.240179     Biso  1.000000 C
   C53        1.0     0.454798      0.324626      0.231609     Biso  1.000000 C
   C54        1.0     0.455177      0.827899      0.240172     Biso  1.000000 C
   C55        1.0     0.955682      0.327298      0.240024     Biso  1.000000 C
   C56        1.0     0.955283      0.827980      0.239090     Biso  1.000000 C
   C57        1.0     0.394823      0.345022      0.761472     Biso  1.000000 C
   C58        1.0     0.396349      0.848399      0.758772     Biso  1.000000 C
   C59        1.0     0.890069      0.344913      0.761020     Biso  1.000000 C
   C60        1.0     0.893174      0.845644      0.760814     Biso  1.000000 C
   C61        1.0     0.119040      0.155960      0.239526     Biso  1.000000 C
   C62        1.0     0.118262      0.655076      0.240745     Biso  1.000000 C
   C63        1.0     0.620608      0.155895      0.239278     Biso  1.000000 C
   C64        1.0     0.620640      0.656114      0.240595     Biso  1.000000 C
   H1         1.0     0.159140      0.459705      0.817266     Biso  1.000000 H
   H2         1.0     0.378722      0.279092      0.182030     Biso  1.000000 H
   H3         1.0     0.289188      0.369794      0.672984     Biso  1.000000 H
   H4         1.0     0.709378      0.626431      0.327131     Biso  1.000000 H
