432 Lattice="21.35940954652711 0.0 0.0 21.359409546527107 26.15982729806163 0.0 0.0 0.0 49.32744340567557" Properties=species:S:1:pos:R:3 pbc="T T F" Ba 0.00000000 0.00000000 0.00000000 Ba 7.11980318 4.35997122 -0.00000000 Ba 24.91931114 23.25317982 2.05531014 Ba 10.67970477 1.45332374 2.05531014 Ba 28.47921273 20.34653234 4.11062028 Ba 35.59901591 24.70650356 4.11062028 Ba 32.03911432 17.43988487 6.16593043 Ba 17.79950796 21.79985608 6.16593043 Ba 14.23960636 14.53323739 8.22124057 Ba 21.35940955 18.89320860 8.22124057 Ba 17.79950796 11.62658991 10.27655071 Ba 24.91931114 15.98656113 10.27655071 Ba 21.35940955 8.71994243 12.33186085 Ba 28.47921273 13.07991365 12.33186085 Ba 24.91931114 5.81329496 14.38717099 Ba 10.67970477 10.17326617 14.38717099 Ba 7.11980318 2.90664748 16.44248114 Ba 14.23960636 7.26661869 16.44248114 Ba 10.67970477 0.00000000 18.49779128 Ba 17.79950796 4.35997122 18.49779128 Ba 35.59901591 23.25317982 20.55310142 Ba 21.35940955 1.45332374 20.55310142 Ba 17.79950796 20.34653234 22.60841156 Ba 24.91931114 24.70650356 22.60841156 Ba 21.35940955 17.43988487 24.66372170 Ba 28.47921273 21.79985608 24.66372170 Ba 24.91931114 14.53323739 26.71903184 Ba 32.03911432 18.89320860 26.71903184 Ba 28.47921273 11.62658991 28.77434199 Ba 14.23960636 15.98656113 28.77434199 Ba 10.67970477 8.71994243 30.82965213 Ba 17.79950796 13.07991365 30.82965213 Ba 14.23960636 5.81329496 32.88496227 Ba 21.35940955 10.17326617 32.88496227 Ba 17.79950796 2.90664748 34.94027241 Ba 24.91931114 7.26661869 34.94027241 Ba 0.00000000 0.00000000 36.99558255 Ba 7.11980318 4.35997122 36.99558255 Ba 24.91931114 23.25317982 39.05089270 Ba 10.67970477 1.45332374 39.05089270 Ba 28.47921273 20.34653234 41.10620284 Ba 35.59901591 24.70650356 41.10620284 Ba 32.03911432 17.43988487 43.16151298 Ba 17.79950796 21.79985608 43.16151298 Ba 14.23960636 14.53323739 45.21682312 Ba 21.35940955 18.89320860 45.21682312 Ba 17.79950796 11.62658991 47.27213326 Ba 24.91931114 15.98656113 47.27213326 Ba 7.11980318 8.71994243 0.00000000 Ba 14.23960636 13.07991365 0.00000000 Ba 10.67970477 5.81329496 2.05531014 Ba 17.79950796 10.17326617 2.05531014 Ba 14.23960636 2.90664748 4.11062028 Ba 21.35940955 7.26661869 4.11062028 Ba 17.79950796 0.00000000 6.16593043 Ba 3.55990159 4.35997122 6.16593043 Ba 21.35940955 23.25317982 8.22124057 Ba 7.11980318 1.45332374 8.22124057 Ba 24.91931114 20.34653234 10.27655071 Ba 32.03911432 24.70650356 10.27655071 Ba 28.47921273 17.43988487 12.33186085 Ba 35.59901591 21.79985608 12.33186085 Ba 32.03911432 14.53323739 14.38717099 Ba 17.79950796 18.89320860 14.38717099 Ba 14.23960636 11.62658991 16.44248114 Ba 21.35940955 15.98656113 16.44248114 Ba 17.79950796 8.71994243 18.49779128 Ba 24.91931114 13.07991365 18.49779128 Ba 21.35940955 5.81329496 20.55310142 Ba 28.47921273 10.17326617 20.55310142 Ba 3.55990159 2.90664748 22.60841156 Ba 10.67970477 7.26661869 22.60841156 Ba 7.11980318 0.00000000 24.66372170 Ba 14.23960636 4.35997122 24.66372170 Ba 32.03911432 23.25317982 26.71903184 Ba 17.79950796 1.45332374 26.71903184 Ba 35.59901591 20.34653234 28.77434199 Ba 21.35940955 24.70650356 28.77434199 Ba 17.79950796 17.43988487 30.82965213 Ba 24.91931114 21.79985608 30.82965213 Ba 21.35940955 14.53323739 32.88496227 Ba 28.47921273 18.89320860 32.88496227 Ba 24.91931114 11.62658991 34.94027241 Ba 32.03911432 15.98656113 34.94027241 Ba 7.11980318 8.71994243 36.99558255 Ba 14.23960636 13.07991365 36.99558255 Ba 10.67970477 5.81329496 39.05089270 Ba 17.79950796 10.17326617 39.05089270 Ba 14.23960636 2.90664748 41.10620284 Ba 21.35940955 7.26661869 41.10620284 Ba 17.79950796 0.00000000 43.16151298 Ba 3.55990159 4.35997122 43.16151298 Ba 21.35940955 23.25317982 45.21682312 Ba 7.11980318 1.45332374 45.21682312 Ba 24.91931114 20.34653234 47.27213326 Ba 32.03911432 24.70650356 47.27213326 Ba 14.23960636 17.43988487 0.00000000 Ba 21.35940955 21.79985608 0.00000000 Ba 17.79950796 14.53323739 2.05531014 Ba 24.91931114 18.89320860 2.05531014 Ba 21.35940955 11.62658991 4.11062028 Ba 28.47921273 15.98656113 4.11062028 Ba 24.91931114 8.71994243 6.16593043 Ba 10.67970477 13.07991365 6.16593043 Ba 7.11980318 5.81329496 8.22124057 Ba 14.23960636 10.17326617 8.22124057 Ba 10.67970477 2.90664748 10.27655071 Ba 17.79950796 7.26661869 10.27655071 Ba 14.23960636 0.00000000 12.33186085 Ba 21.35940955 4.35997122 12.33186085 Ba 39.15891750 23.25317982 14.38717099 Ba 3.55990159 1.45332374 14.38717099 Ba 21.35940955 20.34653234 16.44248114 Ba 28.47921273 24.70650356 16.44248114 Ba 24.91931114 17.43988487 18.49779128 Ba 32.03911432 21.79985608 18.49779128 Ba 28.47921273 14.53323739 20.55310142 Ba 35.59901591 18.89320860 20.55310142 Ba 10.67970477 11.62658991 22.60841156 Ba 17.79950796 15.98656113 22.60841156 Ba 14.23960636 8.71994243 24.66372170 Ba 21.35940955 13.07991365 24.66372170 Ba 17.79950796 5.81329496 26.71903184 Ba 24.91931114 10.17326617 26.71903184 Ba 21.35940955 2.90664748 28.77434199 Ba 7.11980318 7.26661869 28.77434199 Ba 24.91931114 26.15982730 30.82965213 Ba 10.67970477 4.35997122 30.82965213 Ba 28.47921273 23.25317982 32.88496227 Ba 14.23960636 1.45332374 32.88496227 Ba 32.03911432 20.34653234 34.94027241 Ba 39.15891750 24.70650356 34.94027241 Ba 14.23960636 17.43988487 36.99558255 Ba 21.35940955 21.79985608 36.99558255 Ba 17.79950796 14.53323739 39.05089270 Ba 24.91931114 18.89320860 39.05089270 Ba 21.35940955 11.62658991 41.10620284 Ba 28.47921273 15.98656113 41.10620284 Ba 24.91931114 8.71994243 43.16151298 Ba 10.67970477 13.07991365 43.16151298 Ba 7.11980318 5.81329496 45.21682312 Ba 14.23960636 10.17326617 45.21682312 Ba 10.67970477 2.90664748 47.27213326 Ba 17.79950796 7.26661869 47.27213326 Ba 7.11980318 0.00000000 -0.00000000 Ba 14.23960636 4.35997122 -0.00000000 Ba 32.03911432 23.25317982 2.05531014 Ba 17.79950796 1.45332374 2.05531014 Ba 35.59901591 20.34653234 4.11062028 Ba 21.35940955 24.70650356 4.11062028 Ba 17.79950796 17.43988487 6.16593043 Ba 24.91931114 21.79985608 6.16593043 Ba 21.35940955 14.53323739 8.22124057 Ba 28.47921273 18.89320860 8.22124057 Ba 24.91931114 11.62658991 10.27655071 Ba 32.03911432 15.98656113 10.27655071 Ba 7.11980318 8.71994243 12.33186085 Ba 14.23960636 13.07991365 12.33186085 Ba 10.67970477 5.81329496 14.38717099 Ba 17.79950796 10.17326617 14.38717099 Ba 14.23960636 2.90664748 16.44248114 Ba 21.35940955 7.26661869 16.44248114 Ba 39.15891750 26.15982730 18.49779128 Ba 3.55990159 4.35997122 18.49779128 Ba 21.35940955 23.25317982 20.55310142 Ba 7.11980318 1.45332374 20.55310142 Ba 24.91931114 20.34653234 22.60841156 Ba 32.03911432 24.70650356 22.60841156 Ba 28.47921273 17.43988487 24.66372170 Ba 35.59901591 21.79985608 24.66372170 Ba 32.03911432 14.53323739 26.71903184 Ba 17.79950796 18.89320860 26.71903184 Ba 14.23960636 11.62658991 28.77434199 Ba 21.35940955 15.98656113 28.77434199 Ba 17.79950796 8.71994243 30.82965213 Ba 24.91931114 13.07991365 30.82965213 Ba 21.35940955 5.81329496 32.88496227 Ba 28.47921273 10.17326617 32.88496227 Ba 3.55990159 2.90664748 34.94027241 Ba 10.67970477 7.26661869 34.94027241 Ba 7.11980318 0.00000000 36.99558255 Ba 14.23960636 4.35997122 36.99558255 Ba 32.03911432 23.25317982 39.05089270 Ba 17.79950796 1.45332374 39.05089270 Ba 35.59901591 20.34653234 41.10620284 Ba 21.35940955 24.70650356 41.10620284 Ba 17.79950796 17.43988487 43.16151298 Ba 24.91931114 21.79985608 43.16151298 Ba 21.35940955 14.53323739 45.21682312 Ba 28.47921273 18.89320860 45.21682312 Ba 24.91931114 11.62658991 47.27213326 Ba 32.03911432 15.98656113 47.27213326 Ba 14.23960636 8.71994243 -0.00000000 Ba 21.35940955 13.07991365 -0.00000000 Ba 17.79950796 5.81329496 2.05531014 Ba 24.91931114 10.17326617 2.05531014 Ba 21.35940955 2.90664748 4.11062028 Ba 7.11980318 7.26661869 4.11062028 Ba 3.55990159 0.00000000 6.16593043 Ba 10.67970477 4.35997122 6.16593043 Ba 28.47921273 23.25317982 8.22124057 Ba 14.23960636 1.45332374 8.22124057 Ba 32.03911432 20.34653234 10.27655071 Ba 39.15891750 24.70650356 10.27655071 Ba 14.23960636 17.43988487 12.33186085 Ba 21.35940955 21.79985608 12.33186085 Ba 17.79950796 14.53323739 14.38717099 Ba 24.91931114 18.89320860 14.38717099 Ba 21.35940955 11.62658991 16.44248114 Ba 28.47921273 15.98656113 16.44248114 Ba 24.91931114 8.71994243 18.49779128 Ba 10.67970477 13.07991365 18.49779128 Ba 7.11980318 5.81329496 20.55310142 Ba 14.23960636 10.17326617 20.55310142 Ba 10.67970477 2.90664748 22.60841156 Ba 17.79950796 7.26661869 22.60841156 Ba 35.59901591 26.15982730 24.66372170 Ba 21.35940955 4.35997122 24.66372170 Ba 39.15891750 23.25317982 26.71903184 Ba 3.55990159 1.45332374 26.71903184 Ba 21.35940955 20.34653234 28.77434199 Ba 28.47921273 24.70650356 28.77434199 Ba 24.91931114 17.43988487 30.82965213 Ba 32.03911432 21.79985608 30.82965213 Ba 28.47921273 14.53323739 32.88496227 Ba 35.59901591 18.89320860 32.88496227 Ba 10.67970477 11.62658991 34.94027241 Ba 17.79950796 15.98656113 34.94027241 Ba 14.23960636 8.71994243 36.99558255 Ba 21.35940955 13.07991365 36.99558255 Ba 17.79950796 5.81329496 39.05089270 Ba 24.91931114 10.17326617 39.05089270 Ba 21.35940955 2.90664748 41.10620284 Ba 7.11980318 7.26661869 41.10620284 Ba 3.55990159 0.00000000 43.16151298 Ba 10.67970477 4.35997122 43.16151298 Ba 28.47921273 23.25317982 45.21682312 Ba 14.23960636 1.45332374 45.21682312 Ba 32.03911432 20.34653234 47.27213326 Ba 39.15891750 24.70650356 47.27213326 Ba 21.35940955 17.43988487 -0.00000000 Ba 28.47921273 21.79985608 -0.00000000 Ba 24.91931114 14.53323739 2.05531014 Ba 32.03911432 18.89320860 2.05531014 Ba 28.47921273 11.62658991 4.11062028 Ba 14.23960636 15.98656113 4.11062028 Ba 10.67970477 8.71994243 6.16593043 Ba 17.79950796 13.07991365 6.16593043 Ba 14.23960636 5.81329496 8.22124057 Ba 21.35940955 10.17326617 8.22124057 Ba 17.79950796 2.90664748 10.27655071 Ba 24.91931114 7.26661869 10.27655071 Ba 0.00000000 0.00000000 12.33186085 Ba 7.11980318 4.35997122 12.33186085 Ba 24.91931114 23.25317982 14.38717099 Ba 10.67970477 1.45332374 14.38717099 Ba 28.47921273 20.34653234 16.44248114 Ba 35.59901591 24.70650356 16.44248114 Ba 32.03911432 17.43988487 18.49779128 Ba 17.79950796 21.79985608 18.49779128 Ba 14.23960636 14.53323739 20.55310142 Ba 21.35940955 18.89320860 20.55310142 Ba 17.79950796 11.62658991 22.60841156 Ba 24.91931114 15.98656113 22.60841156 Ba 21.35940955 8.71994243 24.66372170 Ba 28.47921273 13.07991365 24.66372170 Ba 24.91931114 5.81329496 26.71903184 Ba 10.67970477 10.17326617 26.71903184 Ba 7.11980318 2.90664748 28.77434199 Ba 14.23960636 7.26661869 28.77434199 Ba 10.67970477 0.00000000 30.82965213 Ba 17.79950796 4.35997122 30.82965213 Ba 35.59901591 23.25317982 32.88496227 Ba 21.35940955 1.45332374 32.88496227 Ba 17.79950796 20.34653234 34.94027241 Ba 24.91931114 24.70650356 34.94027241 Ba 21.35940955 17.43988487 36.99558255 Ba 28.47921273 21.79985608 36.99558255 Ba 24.91931114 14.53323739 39.05089270 Ba 32.03911432 18.89320860 39.05089270 Ba 28.47921273 11.62658991 41.10620284 Ba 14.23960636 15.98656113 41.10620284 Ba 10.67970477 8.71994243 43.16151298 Ba 17.79950796 13.07991365 43.16151298 Ba 14.23960636 5.81329496 45.21682312 Ba 21.35940955 10.17326617 45.21682312 Ba 17.79950796 2.90664748 47.27213326 Ba 24.91931114 7.26661869 47.27213326 Ba 14.23960636 0.00000000 -0.00000000 Ba 21.35940955 4.35997122 -0.00000000 Ba 39.15891750 23.25317982 2.05531014 Ba 3.55990159 1.45332374 2.05531014 Ba 21.35940955 20.34653234 4.11062028 Ba 28.47921273 24.70650356 4.11062028 Ba 24.91931114 17.43988487 6.16593043 Ba 32.03911432 21.79985608 6.16593043 Ba 28.47921273 14.53323739 8.22124057 Ba 35.59901591 18.89320860 8.22124057 Ba 10.67970477 11.62658991 10.27655071 Ba 17.79950796 15.98656113 10.27655071 Ba 14.23960636 8.71994243 12.33186085 Ba 21.35940955 13.07991365 12.33186085 Ba 17.79950796 5.81329496 14.38717099 Ba 24.91931114 10.17326617 14.38717099 Ba 21.35940955 2.90664748 16.44248114 Ba 7.11980318 7.26661869 16.44248114 Ba 3.55990159 0.00000000 18.49779128 Ba 10.67970477 4.35997122 18.49779128 Ba 28.47921273 23.25317982 20.55310142 Ba 14.23960636 1.45332374 20.55310142 Ba 32.03911432 20.34653234 22.60841156 Ba 39.15891750 24.70650356 22.60841156 Ba 14.23960636 17.43988487 24.66372170 Ba 21.35940955 21.79985608 24.66372170 Ba 17.79950796 14.53323739 26.71903184 Ba 24.91931114 18.89320860 26.71903184 Ba 21.35940955 11.62658991 28.77434199 Ba 28.47921273 15.98656113 28.77434199 Ba 24.91931114 8.71994243 30.82965213 Ba 10.67970477 13.07991365 30.82965213 Ba 7.11980318 5.81329496 32.88496227 Ba 14.23960636 10.17326617 32.88496227 Ba 10.67970477 2.90664748 34.94027241 Ba 17.79950796 7.26661869 34.94027241 Ba 35.59901591 26.15982730 36.99558255 Ba 21.35940955 4.35997122 36.99558255 Ba 39.15891750 23.25317982 39.05089270 Ba 3.55990159 1.45332374 39.05089270 Ba 21.35940955 20.34653234 41.10620284 Ba 28.47921273 24.70650356 41.10620284 Ba 24.91931114 17.43988487 43.16151298 Ba 32.03911432 21.79985608 43.16151298 Ba 28.47921273 14.53323739 45.21682312 Ba 35.59901591 18.89320860 45.21682312 Ba 10.67970477 11.62658991 47.27213326 Ba 17.79950796 15.98656113 47.27213326 Ba 21.35940955 8.71994243 -0.00000000 Ba 28.47921273 13.07991365 -0.00000000 Ba 24.91931114 5.81329496 2.05531014 Ba 10.67970477 10.17326617 2.05531014 Ba 7.11980318 2.90664748 4.11062028 Ba 14.23960636 7.26661869 4.11062028 Ba 10.67970477 0.00000000 6.16593043 Ba 17.79950796 4.35997122 6.16593043 Ba 35.59901591 23.25317982 8.22124057 Ba 21.35940955 1.45332374 8.22124057 Ba 17.79950796 20.34653234 10.27655071 Ba 24.91931114 24.70650356 10.27655071 Ba 21.35940955 17.43988487 12.33186085 Ba 28.47921273 21.79985608 12.33186085 Ba 24.91931114 14.53323739 14.38717099 Ba 32.03911432 18.89320860 14.38717099 Ba 28.47921273 11.62658991 16.44248114 Ba 14.23960636 15.98656113 16.44248114 Ba 10.67970477 8.71994243 18.49779128 Ba 17.79950796 13.07991365 18.49779128 Ba 14.23960636 5.81329496 20.55310142 Ba 21.35940955 10.17326617 20.55310142 Ba 17.79950796 2.90664748 22.60841156 Ba 24.91931114 7.26661869 22.60841156 Ba 0.00000000 0.00000000 24.66372170 Ba 7.11980318 4.35997122 24.66372170 Ba 24.91931114 23.25317982 26.71903184 Ba 10.67970477 1.45332374 26.71903184 Ba 28.47921273 20.34653234 28.77434199 Ba 35.59901591 24.70650356 28.77434199 Ba 32.03911432 17.43988487 30.82965213 Ba 17.79950796 21.79985608 30.82965213 Ba 14.23960636 14.53323739 32.88496227 Ba 21.35940955 18.89320860 32.88496227 Ba 17.79950796 11.62658991 34.94027241 Ba 24.91931114 15.98656113 34.94027241 Ba 21.35940955 8.71994243 36.99558255 Ba 28.47921273 13.07991365 36.99558255 Ba 24.91931114 5.81329496 39.05089270 Ba 10.67970477 10.17326617 39.05089270 Ba 7.11980318 2.90664748 41.10620284 Ba 14.23960636 7.26661869 41.10620284 Ba 32.03911432 26.15982730 43.16151298 Ba 17.79950796 4.35997122 43.16151298 Ba 35.59901591 23.25317982 45.21682312 Ba 21.35940955 1.45332374 45.21682312 Ba 17.79950796 20.34653234 47.27213326 Ba 24.91931114 24.70650356 47.27213326 Ba 28.47921273 17.43988487 -0.00000000 Ba 35.59901591 21.79985608 -0.00000000 Ba 32.03911432 14.53323739 2.05531014 Ba 17.79950796 18.89320860 2.05531014 Ba 14.23960636 11.62658991 4.11062028 Ba 21.35940955 15.98656113 4.11062028 Ba 17.79950796 8.71994243 6.16593043 Ba 24.91931114 13.07991365 6.16593043 Ba 21.35940955 5.81329496 8.22124057 Ba 28.47921273 10.17326617 8.22124057 Ba 3.55990159 2.90664748 10.27655071 Ba 10.67970477 7.26661869 10.27655071 Ba 7.11980318 0.00000000 12.33186085 Ba 14.23960636 4.35997122 12.33186085 Ba 32.03911432 23.25317982 14.38717099 Ba 17.79950796 1.45332374 14.38717099 Ba 35.59901591 20.34653234 16.44248114 Ba 21.35940955 24.70650356 16.44248114 Ba 17.79950796 17.43988487 18.49779128 Ba 24.91931114 21.79985608 18.49779128 Ba 21.35940955 14.53323739 20.55310142 Ba 28.47921273 18.89320860 20.55310142 Ba 24.91931114 11.62658991 22.60841156 Ba 32.03911432 15.98656113 22.60841156 Ba 7.11980318 8.71994243 24.66372170 Ba 14.23960636 13.07991365 24.66372170 Ba 10.67970477 5.81329496 26.71903184 Ba 17.79950796 10.17326617 26.71903184 Ba 14.23960636 2.90664748 28.77434199 Ba 21.35940955 7.26661869 28.77434199 Ba 39.15891750 26.15982730 30.82965213 Ba 3.55990159 4.35997122 30.82965213 Ba 21.35940955 23.25317982 32.88496227 Ba 7.11980318 1.45332374 32.88496227 Ba 24.91931114 20.34653234 34.94027241 Ba 32.03911432 24.70650356 34.94027241 Ba 28.47921273 17.43988487 36.99558255 Ba 35.59901591 21.79985608 36.99558255 Ba 32.03911432 14.53323739 39.05089270 Ba 17.79950796 18.89320860 39.05089270 Ba 14.23960636 11.62658991 41.10620284 Ba 21.35940955 15.98656113 41.10620284 Ba 17.79950796 8.71994243 43.16151298 Ba 24.91931114 13.07991365 43.16151298 Ba 21.35940955 5.81329496 45.21682312 Ba 28.47921273 10.17326617 45.21682312 Ba 3.55990159 2.90664748 47.27213326 Ba 10.67970477 7.26661869 47.27213326