O Ti 1.0000000000000000 4.8099181177709065 -0.0000000000000000 0.1091922578177218 -0.0000000000000000 4.6286725250656024 0.0000000000000000 0.9361433093158771 0.0000000000000000 4.4867611160985152 O Ti 8 4 Selective dynamics Cartesian 4.9666957602832342 3.2336761011061688 2.0634302369117457 T T T 0.3112940121456128 0.9193398385733689 0.2891425789552313 T T T 0.7793656668035517 1.3949964239594324 2.5325231370044881 T T T 5.4347674149411702 3.7093326864922322 4.3068107949610051 T T T 2.9594315604339863 0.9998126089026480 2.3218440745880962 T T T 2.3185582119948598 3.3141488714354441 0.0307287412788830 T T T 2.7866298666527993 3.6288599161629547 2.2741092993281362 T T T 3.4275032150919222 1.3145236536301526 4.5652246326373547 T T T 3.6633021476382877 4.5491582011688605 1.0582469101884959 T T T 1.6146876247905539 2.2348219386360619 1.2943259056784833 T T T 2.0827592794484939 0.0795143238967376 3.5377064637277349 T T T 4.1313738022962223 2.3938505864295365 3.3016274682377524 T T T