data_fullydisorder_deg4
_audit_creation_method         'generated by CrystalMaker X for macOS'
_cell_length_a                  10.000000
_cell_length_b                  10.000000
_cell_length_c                  26.976801
_cell_angle_alpha               90.000000
_cell_angle_beta                90.000000
_cell_angle_gamma               90.000000

_symmetry_space_group_name_H-M     'P 1'

loop_
_symmetry_equiv_pos_as_xyz
'+x,+y,+z'

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
 C1  C 1.0  0.618797183037  0.065410800278  0.036303255707
 C2  C 1.0  0.586485028267  0.178263410926  0.002486493438
 C3  C 1.0  0.590259730816  0.322277218103  0.025547511876
 C4  C 1.0  0.408209592104  0.629874289036  0.150377318263
 C5  C 1.0  0.535967290401  0.613174259663  0.179305285215
 C6  C 1.0  0.505236446857  0.546258151531  0.230305269361
 C7  C 1.0  0.414628833532  0.421173751354  0.224149227142
 C8  C 1.0  0.328362375498  0.522807836533  0.145891487598
 C9  C 1.0  0.3753939569  0.393804073334  0.169485554099
 C10  C 1.0  0.349782168865  0.428013294935  0.312089949846
 C11  C 1.0  0.449212521315  0.547294318676  0.319307237864
 C12  C 1.0  0.445513427258  0.6384947896  0.272064954042
 C13  C 1.0  0.304302871227  0.674525976181  0.258799344301
 C14  C 1.0  0.28989392519  0.435326844454  0.259180426598
 C15  C 1.0  0.224177002907  0.56916987896  0.251492828131
 C16  C 1.0  0.186443224549  0.669484913349  0.370593369007
 C17  C 1.0  0.325208067894  0.708809137344  0.386995106936
 C18  C 1.0  0.426147371531  0.597373664379  0.373452395201
 C19  C 1.0  0.368611842394  0.469434469938  0.398301869631
 C20  C 1.0  0.15720616281  0.54469025135  0.356696426868
 C21  C 1.0  0.260201126337  0.434343785048  0.359118044376
 C22  C 1.0  0.340725749731  0.735259532928  0.444624185562
 C23  C 1.0  0.214489325881  0.752790272236  0.477292090654
 C24  C 1.0  0.129327207804  0.627442657948  0.476360231638
 C25  C 1.0  0.182154923677  0.507880210876  0.465532451868
 C26  C 1.0  0.404159367085  0.616358280182  0.473101556301
 C27  C 1.0  0.329584807158  0.491063147783  0.453987807035
 C28  C 1.0  0.343526512384  0.893197655678  0.541155934334
 C29  C 1.0  0.457729250193  0.90438503027  0.566788077354
 C30  C 1.0  0.537217915058  0.789100885391  0.586770057678
 C31  C 1.0  0.502595543861  0.650619328022  0.563001513481
 C32  C 1.0  0.277711302042  0.761951506138  0.529967010021
 C33  C 1.0  0.376869559288  0.642134070396  0.529298722744
 C34  C 1.0  0.489227771759  0.546528577805  0.605931580067
 C35  C 1.0  0.373647689819  0.595961987972  0.637079775333
 C36  C 1.0  0.389995723963  0.718613088131  0.656275570393
 C37  C 1.0  0.524180471897  0.778628885746  0.645281732082
 C38  C 1.0  0.624187231064  0.547024786472  0.63434278965
 C39  C 1.0  0.637704372406  0.682983338833  0.662458956242
 C40  C 1.0  0.551236212254  0.604879677296  0.753755569458
 C41  C 1.0  0.664785921574  0.64485257864  0.717635214329
 C42  C 1.0  0.7470048666  0.515724539757  0.710029661655
 C43  C 1.0  0.649408519268  0.438496649265  0.67513692379
 C44  C 1.0  0.466165751219  0.493126392365  0.732816636562
 C45  C 1.0  0.516964197159  0.408184230328  0.699515223503
 C46  C 1.0  0.683501899242  0.4129319489  0.794497311115
 C47  C 1.0  0.602075457573  0.54221457243  0.804089426994
 C48  C 1.0  0.688007831573  0.621906816959  0.841614723206
 C49  C 1.0  0.826829433441  0.643949270248  0.820944130421
 C50  C 1.0  0.798643529415  0.457398474216  0.760134637356
 C51  C 1.0  0.877729177475  0.569154798985  0.784369528294
 C52  C 1.0  0.868449032307  0.354482501745  0.859408020973
 C53  C 1.0  0.723846077919  0.339750617743  0.844838380814
 C54  C 1.0  0.630518496037  0.397208869457  0.885124146938
 C55  C 1.0  0.680517911911  0.542016923428  0.893293082714
 C56  C 1.0  0.90855884552  0.439977735281  0.894416689873
 C57  C 1.0  0.811486840248  0.525148272514  0.923363983631
 C58  C 1.0  0.604455828667  0.326001167297  0.935591995716
 C59  C 1.0  0.632865071297  0.415183246136  0.981208503246
 C60  C 1.0  0.781796097755  0.454540908337  0.97669428587
 C61  C 1.0  0.864597916603  0.329206496477  0.982344448566
 C62  C 1.0  0.670325696468  0.194585517049  0.954019665718
 C63  C 1.0  0.814427018166  0.210032612085  0.969519257545
 C64  C 1.0  0.684119343758  0.213099360466  0.107647545636
 C65  C 1.0  0.655090928078  0.081686295569  0.083611518145
 C66  C 1.0  0.664102852345  0.34332343936  0.075851425529
 C67  C 1.0  0.727442800999  0.442855745554  0.182867720723
 C68  C 1.0  0.699838280678  0.312899202108  0.189480617642
 C69  C 1.0  0.60128813982  0.241591900587  0.156309023499
 C70  C 1.0  0.488414019346  0.33340293169  0.136018410325
 C71  C 1.0  0.644173562527  0.526141107082  0.148099705577
 C72  C 1.0  0.575904250145  0.436404317617  0.108778849244
 H1  H 1.0  0.605161070824  0.96432352066  0.021529436111
 H2  H 1.0  0.023125644773  0.637021124363  0.485330700874
 H3  H 1.0  0.874709606171  0.119403861463  0.973000764847
 H4  H 1.0  0.671841084957  0.993457198143  0.106859974563
 H5  H 1.0  0.482715725899  0.159877061844  0.989911615849
 H6  H 1.0  0.484871387482  0.347686171532  0.03292498365
 H7  H 1.0  0.790188074112  0.207896977663  0.118640087545
 H8  H 1.0  0.60200291872  0.513156831264  0.245120793581
 H9  H 1.0  0.469544559717  0.332447350025  0.237338647246
 H10  H 1.0  0.293366909027  0.320232629776  0.170091658831
 H11  H 1.0  0.233134135604  0.527252852917  0.126159980893
 H12  H 1.0  0.381791174412  0.726741790771  0.134437307715
 H13  H 1.0  0.58264374733  0.711080729961  0.186396926641
 H14  H 1.0  0.509924173355  0.726753354073  0.277036696672
 H15  H 1.0  0.271866321564  0.778173923492  0.254965960979
 H16  H 1.0  0.119118951261  0.577568948269  0.241077199578
 H17  H 1.0  0.220655947924  0.351575404406  0.252619534731
 H18  H 1.0  0.40523198247  0.332732766867  0.314214527607
 H19  H 1.0  0.55162113905  0.506261467934  0.320083707571
 H20  H 1.0  0.523833394051  0.625757336617  0.388895571232
 H21  H 1.0  0.445292234421  0.390214711428  0.397202014923
 H22  H 1.0  0.211407974362  0.337394595146  0.366172730923
 H23  H 1.0  0.05684620887  0.519484937191  0.343647748232
 H24  H 1.0  0.109441451728  0.747109353542  0.370012432337
 H25  H 1.0  0.351855546236  0.802335381508  0.36764985323
 H26  H 1.0  0.118844069541  0.418742060661  0.464680314064
 H27  H 1.0  0.364481210709  0.402587324381  0.47480031848
 H28  H 1.0  0.51197463274  0.60593765974  0.466265559196
 H29  H 1.0  0.403778105974  0.824629366398  0.449457347393
 H30  H 1.0  0.154723033309  0.84206110239  0.468257814646
 H31  H 1.0  0.643764436245  0.810789525509  0.579451143742
 H32  H 1.0  0.589511632919  0.620573937893  0.540408968925
 H33  H 1.0  0.319910407066  0.555132508278  0.542505562305
 H34  H 1.0  0.199555084109  0.74492919445  0.558165192604
 H35  H 1.0  0.291612297297  0.983769059181  0.528852939606
 H36  H 1.0  0.497100889683  0.004217928741  0.574946939945
 H37  H 1.0  0.314911603928  0.770012557507  0.678562939167
 H38  H 1.0  0.536797881126  0.878559291363  0.661682248116
 H39  H 1.0  0.731872677803  0.730950772762  0.650593817234
 H40  H 1.0  0.703740596771  0.538022458553  0.606192290783
 H41  H 1.0  0.469256848097  0.447200894356  0.589965879917
 H42  H 1.0  0.282902538776  0.536827981472  0.641676485538
 H43  H 1.0  0.836784124374  0.539629340172  0.68781709671
 H44  H 1.0  0.694444894791  0.347615242004  0.659310162067
 H45  H 1.0  0.458381295204  0.323688954115  0.68575334549
 H46  H 1.0  0.36715734005  0.476974487305  0.748971760273
 H47  H 1.0  0.488382875919  0.692397415638  0.762610197067
 H48  H 1.0  0.724138438702  0.724104702473  0.735134541988
 H49  H 1.0  0.643019795418  0.720990478992  0.848390638828
 H50  H 1.0  0.887382030487  0.723237991333  0.837563574314
 H51  H 1.0  0.978140950203  0.589610695839  0.770135402679
 H52  H 1.0  0.865792155266  0.372414469719  0.752184450626
 H53  H 1.0  0.621236264706  0.341484546661  0.774237036705
 H54  H 1.0  0.507167458534  0.518266260624  0.822638332844
 H55  H 1.0  0.530673027039  0.399842619896  0.86851722002
 H56  H 1.0  0.607534527779  0.597030222416  0.915917217731
 H57  H 1.0  0.857088208199  0.623302578926  0.93097358942
 H58  H 1.0  0.01452760864  0.446902632713  0.904028892517
 H59  H 1.0  0.942195534706  0.293867051601  0.839635014534
 H60  H 1.0  0.703388810158  0.232385635376  0.839314341545
 H61  H 1.0  0.808817863464  0.52705103159  0.005700529553
 H62  H 1.0  0.968434274197  0.337982535362  0.994591414928
 H63  H 1.0  0.656535625458  0.109603390098  0.928606510162
 H64  H 1.0  0.496487647295  0.303570449352  0.93537658453
 H65  H 1.0  0.570705533028  0.505779266357  0.981672942638
 H66  H 1.0  0.762701570988  0.387698918581  0.06879196316
 H67  H 1.0  0.564307570457  0.148727670312  0.173321679235
 H68  H 1.0  0.435654908419  0.273814976215  0.107640773058
 H69  H 1.0  0.516560316086  0.501256048679  0.08451846242
 H70  H 1.0  0.708635509014  0.598991453648  0.128839120269
 H71  H 1.0  0.805989682674  0.491646528244  0.204533725977
 H72  H 1.0  0.758101046085  0.252174466848  0.215383753181

