# Fileset

[phonopy_mlp_eval_fc2_dataset.yaml.xz](https://mdr.nims.go.jp/filesets/7f2cd2b2-3fe6-48ac-9b42-ba3842572658/download)

## Creator

[Atsushi Togo](https://orcid.org/0000-0001-8393-9766)

## Rights

Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)

## Other metadata

[First-principles lattice thermal conductivity calculation for Sr2CdAs2 / Cmc2_1 (36) / materials id 867203](https://mdr.nims.go.jp/datasets/476cb1fa-d4b6-46dc-9cdc-e5e4cf6957c0)

## Fulltext

phonopy:  version: "2.44.0"  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05space_group:  type: "Cmc2_1"  number: 36  Hall_symbol: "C 2c -2"primitive_matrix:- [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [ -0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [  0.000000000000000,  0.000000000000000,  1.000000000000000 ]supercell_matrix:- [   3,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   2 ]primitive_cell:  lattice:  - [     2.210486385000000,    -8.381188220000002,     0.000000000000000 ] # a  - [     2.210486385000000,     8.381188220000002,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     7.534929300000002 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.465528467256019,  0.534471532743981,  0.735761975826016 ]    mass: 87.620000  - symbol: Sr # 2    coordinates: [  0.296850061224765,  0.703149938775235,  0.392725669165077 ]    mass: 87.620000  - symbol: Sr # 3    coordinates: [  0.703149938775235,  0.296850061224765,  0.892725669165077 ]    mass: 87.620000  - symbol: Sr # 4    coordinates: [  0.534471532743981,  0.465528467256019,  0.235761975826016 ]    mass: 87.620000  - symbol: Cd # 5    coordinates: [  0.904366594054061,  0.095633405945939,  0.078525488501373 ]    mass: 112.411000  - symbol: Cd # 6    coordinates: [  0.095633405945939,  0.904366594054061,  0.578525488501373 ]    mass: 112.411000  - symbol: As # 7    coordinates: [  0.937107160987974,  0.062892839012026,  0.441459910946203 ]    mass: 74.921600  - symbol: As # 8    coordinates: [  0.324028298440850,  0.675971701559150,  0.985885935561331 ]    mass: 74.921600  - symbol: As # 9    coordinates: [  0.675971701559150,  0.324028298440850,  0.485885935561331 ]    mass: 74.921600  - symbol: As # 10    coordinates: [  0.062892839012026,  0.937107160987974,  0.941459910946203 ]    mass: 74.921600  reciprocal_lattice: # without 2pi  - [     0.226194562152890,    -0.059657412156292,     0.000000000000000 ] # a*  - [     0.226194562152890,     0.059657412156292,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.132715246578359 ] # c*unit_cell:  lattice:  - [     4.420972770000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    16.762376440000004,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     7.534929300000002 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.000000000000000,  0.534471532743981,  0.735761975826016 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 2    coordinates: [  0.000000000000000,  0.703149938775235,  0.392725669165077 ]    mass: 87.620000    reduced_to: 2  - symbol: Sr # 3    coordinates: [  0.500000000000000,  0.796850061224765,  0.892725669165077 ]    mass: 87.620000    reduced_to: 3  - symbol: Sr # 4    coordinates: [  0.500000000000000,  0.965528467256019,  0.235761975826016 ]    mass: 87.620000    reduced_to: 4  - symbol: Sr # 5    coordinates: [  0.500000000000000,  0.034471532743981,  0.735761975826016 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 6    coordinates: [  0.500000000000000,  0.203149938775235,  0.392725669165077 ]    mass: 87.620000    reduced_to: 2  - symbol: Sr # 7    coordinates: [  0.000000000000000,  0.296850061224765,  0.892725669165077 ]    mass: 87.620000    reduced_to: 3  - symbol: Sr # 8    coordinates: [  0.000000000000000,  0.465528467256019,  0.235761975826016 ]    mass: 87.620000    reduced_to: 4  - symbol: Cd # 9    coordinates: [  0.500000000000000,  0.595633405945939,  0.078525488501373 ]    mass: 112.411000    reduced_to: 9  - symbol: Cd # 10    coordinates: [  0.000000000000000,  0.904366594054061,  0.578525488501373 ]    mass: 112.411000    reduced_to: 10  - symbol: Cd # 11    coordinates: [  0.000000000000000,  0.095633405945939,  0.078525488501373 ]    mass: 112.411000    reduced_to: 9  - symbol: Cd # 12    coordinates: [  0.500000000000000,  0.404366594054061,  0.578525488501373 ]    mass: 112.411000    reduced_to: 10  - symbol: As # 13    coordinates: [  0.500000000000000,  0.562892839012026,  0.441459910946203 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 14    coordinates: [  0.000000000000000,  0.675971701559150,  0.985885935561331 ]    mass: 74.921600    reduced_to: 14  - symbol: As # 15    coordinates: [  0.500000000000000,  0.824028298440850,  0.485885935561331 ]    mass: 74.921600    reduced_to: 15  - symbol: As # 16    coordinates: [  0.000000000000000,  0.937107160987974,  0.941459910946203 ]    mass: 74.921600    reduced_to: 16  - symbol: As # 17    coordinates: [  0.000000000000000,  0.062892839012026,  0.441459910946203 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 18    coordinates: [  0.500000000000000,  0.175971701559150,  0.985885935561331 ]    mass: 74.921600    reduced_to: 14  - symbol: As # 19    coordinates: [  0.000000000000000,  0.324028298440850,  0.485885935561331 ]    mass: 74.921600    reduced_to: 15  - symbol: As # 20    coordinates: [  0.500000000000000,  0.437107160987974,  0.941459910946203 ]    mass: 74.921600    reduced_to: 16supercell:  lattice:  - [    13.262918310000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    16.762376440000004,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    15.069858600000003 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.000000000000000,  0.534471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 2    coordinates: [  0.333333333333333,  0.534471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 3    coordinates: [  0.666666666666667,  0.534471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 4    coordinates: [  0.000000000000000,  0.534471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 5    coordinates: [  0.333333333333333,  0.534471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 6    coordinates: [  0.666666666666667,  0.534471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 7    coordinates: [  0.000000000000000,  0.703149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 8    coordinates: [  0.333333333333333,  0.703149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 9    coordinates: [  0.666666666666667,  0.703149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 10    coordinates: [  0.000000000000000,  0.703149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 11    coordinates: [  0.333333333333333,  0.703149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 12    coordinates: [  0.666666666666667,  0.703149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 13    coordinates: [  0.166666666666667,  0.796850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 14    coordinates: [  0.500000000000000,  0.796850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 15    coordinates: [  0.833333333333333,  0.796850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 16    coordinates: [  0.166666666666667,  0.796850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 17    coordinates: [  0.500000000000000,  0.796850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 18    coordinates: [  0.833333333333333,  0.796850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 19    coordinates: [  0.166666666666667,  0.965528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 20    coordinates: [  0.500000000000000,  0.965528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 21    coordinates: [  0.833333333333333,  0.965528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 22    coordinates: [  0.166666666666667,  0.965528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 23    coordinates: [  0.500000000000000,  0.965528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 24    coordinates: [  0.833333333333333,  0.965528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 25    coordinates: [  0.166666666666667,  0.034471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 26    coordinates: [  0.500000000000000,  0.034471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 27    coordinates: [  0.833333333333333,  0.034471532743981,  0.367880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 28    coordinates: [  0.166666666666667,  0.034471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 29    coordinates: [  0.500000000000000,  0.034471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 30    coordinates: [  0.833333333333333,  0.034471532743981,  0.867880987913008 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 31    coordinates: [  0.166666666666667,  0.203149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 32    coordinates: [  0.500000000000000,  0.203149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 33    coordinates: [  0.833333333333333,  0.203149938775235,  0.196362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 34    coordinates: [  0.166666666666667,  0.203149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 35    coordinates: [  0.500000000000000,  0.203149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 36    coordinates: [  0.833333333333333,  0.203149938775235,  0.696362834582539 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 37    coordinates: [  0.000000000000000,  0.296850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 38    coordinates: [  0.333333333333333,  0.296850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 39    coordinates: [  0.666666666666667,  0.296850061224765,  0.446362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 40    coordinates: [  0.000000000000000,  0.296850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 41    coordinates: [  0.333333333333333,  0.296850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 42    coordinates: [  0.666666666666667,  0.296850061224765,  0.946362834582539 ]    mass: 87.620000    reduced_to: 13  - symbol: Sr # 43    coordinates: [  0.000000000000000,  0.465528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 44    coordinates: [  0.333333333333333,  0.465528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 45    coordinates: [  0.666666666666667,  0.465528467256019,  0.117880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 46    coordinates: [  0.000000000000000,  0.465528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 47    coordinates: [  0.333333333333333,  0.465528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Sr # 48    coordinates: [  0.666666666666667,  0.465528467256019,  0.617880987913008 ]    mass: 87.620000    reduced_to: 19  - symbol: Cd # 49    coordinates: [  0.166666666666667,  0.595633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 50    coordinates: [  0.500000000000000,  0.595633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 51    coordinates: [  0.833333333333333,  0.595633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 52    coordinates: [  0.166666666666667,  0.595633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 53    coordinates: [  0.500000000000000,  0.595633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 54    coordinates: [  0.833333333333333,  0.595633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 55    coordinates: [  0.000000000000000,  0.904366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 56    coordinates: [  0.333333333333333,  0.904366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 57    coordinates: [  0.666666666666667,  0.904366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 58    coordinates: [  0.000000000000000,  0.904366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 59    coordinates: [  0.333333333333333,  0.904366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 60    coordinates: [  0.666666666666667,  0.904366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 61    coordinates: [  0.000000000000000,  0.095633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 62    coordinates: [  0.333333333333333,  0.095633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 63    coordinates: [  0.666666666666667,  0.095633405945939,  0.039262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 64    coordinates: [  0.000000000000000,  0.095633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 65    coordinates: [  0.333333333333333,  0.095633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 66    coordinates: [  0.666666666666667,  0.095633405945939,  0.539262744250687 ]    mass: 112.411000    reduced_to: 49  - symbol: Cd # 67    coordinates: [  0.166666666666667,  0.404366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 68    coordinates: [  0.500000000000000,  0.404366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 69    coordinates: [  0.833333333333333,  0.404366594054061,  0.289262744250686 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 70    coordinates: [  0.166666666666667,  0.404366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 71    coordinates: [  0.500000000000000,  0.404366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: Cd # 72    coordinates: [  0.833333333333333,  0.404366594054061,  0.789262744250687 ]    mass: 112.411000    reduced_to: 55  - symbol: As # 73    coordinates: [  0.166666666666667,  0.562892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 74    coordinates: [  0.500000000000000,  0.562892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 75    coordinates: [  0.833333333333333,  0.562892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 76    coordinates: [  0.166666666666667,  0.562892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 77    coordinates: [  0.500000000000000,  0.562892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 78    coordinates: [  0.833333333333333,  0.562892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 79    coordinates: [  0.000000000000000,  0.675971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 80    coordinates: [  0.333333333333333,  0.675971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 81    coordinates: [  0.666666666666667,  0.675971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 82    coordinates: [  0.000000000000000,  0.675971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 83    coordinates: [  0.333333333333333,  0.675971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 84    coordinates: [  0.666666666666667,  0.675971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 85    coordinates: [  0.166666666666667,  0.824028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 86    coordinates: [  0.500000000000000,  0.824028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 87    coordinates: [  0.833333333333333,  0.824028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 88    coordinates: [  0.166666666666667,  0.824028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 89    coordinates: [  0.500000000000000,  0.824028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 90    coordinates: [  0.833333333333333,  0.824028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 91    coordinates: [  0.000000000000000,  0.937107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 92    coordinates: [  0.333333333333333,  0.937107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 93    coordinates: [  0.666666666666667,  0.937107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 94    coordinates: [  0.000000000000000,  0.937107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 95    coordinates: [  0.333333333333333,  0.937107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 96    coordinates: [  0.666666666666667,  0.937107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 97    coordinates: [  0.000000000000000,  0.062892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 98    coordinates: [  0.333333333333333,  0.062892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 99    coordinates: [  0.666666666666667,  0.062892839012026,  0.220729955473102 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 100    coordinates: [  0.000000000000000,  0.062892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 101    coordinates: [  0.333333333333333,  0.062892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 102    coordinates: [  0.666666666666667,  0.062892839012026,  0.720729955473101 ]    mass: 74.921600    reduced_to: 73  - symbol: As # 103    coordinates: [  0.166666666666667,  0.175971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 104    coordinates: [  0.500000000000000,  0.175971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 105    coordinates: [  0.833333333333333,  0.175971701559150,  0.492942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 106    coordinates: [  0.166666666666667,  0.175971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 107    coordinates: [  0.500000000000000,  0.175971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 108    coordinates: [  0.833333333333333,  0.175971701559150,  0.992942967780665 ]    mass: 74.921600    reduced_to: 79  - symbol: As # 109    coordinates: [  0.000000000000000,  0.324028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 110    coordinates: [  0.333333333333333,  0.324028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 111    coordinates: [  0.666666666666667,  0.324028298440850,  0.242942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 112    coordinates: [  0.000000000000000,  0.324028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 113    coordinates: [  0.333333333333333,  0.324028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 114    coordinates: [  0.666666666666667,  0.324028298440850,  0.742942967780665 ]    mass: 74.921600    reduced_to: 85  - symbol: As # 115    coordinates: [  0.166666666666667,  0.437107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 116    coordinates: [  0.500000000000000,  0.437107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 117    coordinates: [  0.833333333333333,  0.437107160987974,  0.470729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 118    coordinates: [  0.166666666666667,  0.437107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 119    coordinates: [  0.500000000000000,  0.437107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91  - symbol: As # 120    coordinates: [  0.833333333333333,  0.437107160987974,  0.970729955473101 ]    mass: 74.921600    reduced_to: 91nac:  born_effective_charge:  - # 1 (Sr)    - [  2.407759598000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  1.272805610000000,  0.041225240000000 ]    - [  0.000000000000000,  0.110289570000000,  2.511092150000000 ]  - # 2 (Sr)    - [  2.384343408000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  3.278779249999999,  0.544138780000000 ]    - [  0.000000000000000,  0.639791600000000,  1.792726560000000 ]  - # 3 (Sr)    - [  2.384343408000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  3.278779249999999, -0.544138780000000 ]    - [  0.000000000000000, -0.639791600000000,  1.792726560000000 ]  - # 4 (Sr)    - [  2.407759598000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  1.272805610000000, -0.041225240000000 ]    - [  0.000000000000000, -0.110289570000000,  2.511092150000000 ]  - # 5 (Cd)    - [  2.065081638000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  1.550290670000000, -0.089397920000000 ]    - [  0.000000000000000,  0.231112600000000,  1.727828060000000 ]  - # 6 (Cd)    - [  2.065081638000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000,  1.550290670000000,  0.089397920000000 ]    - [  0.000000000000000, -0.231112600000000,  1.727828060000000 ]  - # 7 (As)    - [ -3.134294992000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000, -2.911680019999999,  0.501569180000000 ]    - [  0.000000000000000,  0.001034550000000, -3.296882560000000 ]  - # 8 (As)    - [ -3.722889651999999,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000, -3.190195510000000,  0.297763340000000 ]    - [  0.000000000000000,  0.052304760000000, -2.734764210000000 ]  - # 9 (As)    - [ -3.722889651999999,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000, -3.190195510000000, -0.297763340000000 ]    - [  0.000000000000000, -0.052304760000000, -2.734764210000000 ]  - # 10 (As)    - [ -3.134294992000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000, -2.911680019999999, -0.501569180000000 ]    - [  0.000000000000000, -0.001034550000000, -3.296882560000000 ]  dielectric_constant:    - [ 14.283190290000000,  0.000000000000000,  0.000000000000000 ]    - [  0.000000000000000, 11.504217700000000,  0.000000000000000 ]    - [  0.000000000000000,  0.000000000000000, 11.886341390000000 ]  unit_conversion_factor: 14.399652dataset:  displacements:  - # 1    - [    0.0040789733016531,    0.0067777366646713,   -0.0061175372911631 ]    - [   -0.0033288406052467,   -0.0066086171992418,    0.0067264402873100 ]    - [    0.0005475235274748,   -0.0037139622822646,    0.0092685868476687 ]    - [    0.0024877877952656,    0.0015204994624966,   -0.0095655106121041 ]    - [   -0.0039273877141490,    0.0066463527245925,    0.0063562269628337 ]    - [    0.0051031089086151,    0.0081434713921183,    0.0027644444564079 ]    - [   -0.0011937969169491,    0.0030291721813702,   -0.0094551025809716 ]    - [   -0.0034183756514844,   -0.0042719681079091,    0.0083704836413642 ]    - [   -0.0093113736376883,    0.0021880119787567,   -0.0029173488924330 ]    - [    0.0057939040561887,    0.0001574198883180,   -0.0081489812103380 ]    - [   -0.0031552178002555,    0.0009783474768889,    0.0094386141380722 ]    - [    0.0076687751667491,   -0.0027661896746228,    0.0057912073115942 ]    - [   -0.0029536936787045,    0.0055822177725561,    0.0077533565887388 ]    - [    0.0026410252306537,   -0.0057097035884653,   -0.0077733050025660 ]    - [    0.0046966682049992,   -0.0082758285010833,    0.0030744056974978 ]    - [    0.0098094330204350,    0.0000201769292373,    0.0019428372832344 ]    - [   -0.0091950254990059,    0.0028977020456688,    0.0026560927934014 ]    - [    0.0098024461013321,   -0.0019072353107790,   -0.0005239311975794 ]    - [    0.0092607360001272,   -0.0025608660035523,   -0.0027714137272877 ]    - [   -0.0082614270816950,    0.0040369517793460,   -0.0039308832220090 ]    - [    0.0028080112997109,   -0.0027900908469537,    0.0091831620701391 ]    - [    0.0013449858680426,    0.0015576966366040,   -0.0097859385959180 ]    - [   -0.0026438606104718,    0.0093744983867256,   -0.0022646812291525 ]    - [   -0.0069564775854789,    0.0065742157593434,    0.0028960501985169 ]    - [    0.0067826498463347,    0.0029089565028344,    0.0067478613742899 ]    - [    0.0094688529677101,   -0.0030609153579871,    0.0009857081957283 ]    - [    0.0086967888150596,   -0.0049028320702704,   -0.0005728018828381 ]    - [    0.0030672121795932,    0.0059019468533785,    0.0074672105089685 ]    - [   -0.0086929994326870,   -0.0008026958923593,    0.0048772369398761 ]    - [   -0.0084607118456589,   -0.0050742813192173,   -0.0016334087541611 ]    - [   -0.0045305867656429,    0.0003579790854075,    0.0089076166584217 ]    - [    0.0070398690422330,    0.0011052523912880,   -0.0070156012586065 ]    - [   -0.0020485998325258,   -0.0070261813142782,    0.0068143976157150 ]    - [    0.0031009768451158,   -0.0080554635932195,    0.0050491037723908 ]    - [    0.0065314489902961,    0.0029498346638263,   -0.0069741414914847 ]    - [    0.0025432768719024,   -0.0023356810910134,    0.0093848993917851 ]    - [    0.0016394845305671,   -0.0055349557029171,   -0.0081655591260352 ]    - [   -0.0021633096564815,    0.0096271029539628,    0.0016244937808361 ]    - [   -0.0077082533316783,   -0.0029426643357219,    0.0056500935551494 ]    - [   -0.0080278886818009,   -0.0021485300999791,   -0.0055620878923383 ]    - [   -0.0085411888431484,   -0.0002100727902065,   -0.0051965337070486 ]    - [    0.0074057508519713,   -0.0067139235383484,    0.0002794370049526 ]    - [   -0.0041808073169367,   -0.0034746516013982,    0.0083933096230003 ]    - [    0.0032317851114807,    0.0007654986342427,    0.0094323685696745 ]    - [    0.0068707050581302,   -0.0071874107679564,   -0.0010651471526737 ]    - [    0.0057291767332753,   -0.0002418163333477,   -0.0081925611880426 ]    - [    0.0091201082793258,    0.0033088308731651,    0.0024238942275114 ]    - [    0.0063832404804857,    0.0011647138495059,   -0.0076090526754030 ]    - [   -0.0057437499607750,   -0.0015136285363596,   -0.0080447663136983 ]    - [    0.0063197620469520,   -0.0059413185466525,    0.0049760769283752 ]    - [    0.0063897209998160,   -0.0014178328462511,    0.0075605036581303 ]    - [    0.0070579221407974,    0.0070839544137562,   -0.0000576621042487 ]    - [   -0.0057428147371433,   -0.0024485394323204,   -0.0078118329182864 ]    - [    0.0089266029496656,    0.0012562862814532,    0.0043286839291006 ]    - [    0.0064193625173639,    0.0008221275411858,    0.0076233779374164 ]    - [    0.0006649651296236,   -0.0037467184145886,    0.0092476982270275 ]    - [    0.0085254754892795,   -0.0048494121330266,    0.0019492228312199 ]    - [    0.0064938454276808,   -0.0057932854955368,    0.0049262373804550 ]    - [   -0.0054741464918211,   -0.0083432132670102,    0.0006515462894284 ]    - [   -0.0081571079531663,   -0.0033348400402135,    0.0047265665917852 ]    - [    0.0015275475286157,    0.0044031571499833,   -0.0088475310488504 ]    - [   -0.0023986331427330,   -0.0051082308708049,   -0.0082554549491314 ]    - [    0.0025085469487527,    0.0040315573991905,    0.0088007804848738 ]    - [   -0.0059360500261274,   -0.0047246664809367,    0.0065146632093475 ]    - [   -0.0045169287512854,    0.0088351233104091,   -0.0012401414216437 ]    - [   -0.0042517307260842,   -0.0087665880261903,   -0.0022516039198597 ]    - [    0.0065821182698398,    0.0023806964157597,   -0.0071419887746923 ]    - [    0.0024353239457399,    0.0044842517190393,   -0.0086000397556987 ]    - [   -0.0027616657182482,    0.0064846232949423,   -0.0070938609503812 ]    - [   -0.0008513027416467,    0.0003433231074141,    0.0099577815243146 ]    - [    0.0050535202926078,    0.0061010424689957,    0.0061023940747638 ]    - [   -0.0075263476135709,   -0.0053922322594537,   -0.0037786138807508 ]    - [   -0.0079737465383546,    0.0010182941257828,    0.0059483143171385 ]    - [    0.0089248383001589,    0.0013129426960833,    0.0043154887084568 ]    - [   -0.0017981240132355,   -0.0098235504058378,   -0.0005144000942747 ]    - [    0.0010488343965503,   -0.0012632452093464,   -0.0098642869965181 ]    - [    0.0018874594211681,   -0.0090048553599725,    0.0039179174161049 ]    - [    0.0071714194695017,   -0.0043047218394067,    0.0054808861215853 ]    - [    0.0081102508869327,    0.0020949031046432,    0.0054621618003464 ]    - [    0.0004016858268674,   -0.0097027804426791,    0.0023863570934917 ]    - [   -0.0062443265191818,    0.0000394989331861,    0.0078106866635476 ]    - [   -0.0082441803566087,   -0.0028411525982427,   -0.0048950323963387 ]    - [    0.0049862813071098,   -0.0041292176897476,   -0.0076214539293394 ]    - [   -0.0094042190543208,    0.0028471743565570,   -0.0018585645433273 ]    - [   -0.0050967223249287,    0.0085324162948942,   -0.0011051215829929 ]    - [   -0.0061149020461972,    0.0001314706603441,   -0.0079114277112846 ]    - [    0.0064494890254219,   -0.0059575956207565,   -0.0047865588610720 ]    - [   -0.0015047417627083,   -0.0005192709905990,    0.0098724925862663 ]    - [    0.0028191727903481,    0.0086793571259477,    0.0040891349523367 ]    - [   -0.0054630326752316,   -0.0050683918898062,    0.0066683339478987 ]    - [   -0.0095673426558279,    0.0022907904841978,    0.0017939435508080 ]    - [    0.0035776521608888,    0.0053497712397136,    0.0076537802880943 ]    - [    0.0099037837794383,   -0.0001830717339133,   -0.0013716966101791 ]    - [   -0.0032128233621331,    0.0070232742016524,   -0.0063522740441621 ]    - [   -0.0076039469900175,    0.0062488044516966,    0.0017698681017128 ]    - [    0.0055682577122447,    0.0028143950925796,   -0.0078149655349778 ]    - [   -0.0020462374482017,   -0.0097225414979382,   -0.0011336221268332 ]    - [   -0.0016394327280072,    0.0098619605147761,    0.0002323685334483 ]    - [   -0.0073933867728069,    0.0053634355893593,    0.0040707973059927 ]    - [    0.0036803513565150,    0.0084318026283641,   -0.0039191476533694 ]    - [   -0.0009506237860191,   -0.0040479865706122,    0.0090945103849299 ]    - [   -0.0090857117604135,   -0.0038976178277695,    0.0015028030727065 ]    - [    0.0061843727508804,   -0.0075402254309335,   -0.0022132632308134 ]    - [   -0.0058099686054453,    0.0072267703512845,   -0.0037440693227469 ]    - [   -0.0023176031547296,    0.0027266646927471,    0.0093377735713881 ]    - [    0.0002179676894032,    0.0036740685906800,    0.0092980487241870 ]    - [   -0.0031822510785658,    0.0011031446873216,   -0.0094157500960784 ]    - [    0.0047889102255273,   -0.0060922290726768,    0.0063206869704070 ]    - [   -0.0050538796010552,   -0.0080856392140078,    0.0030134265345180 ]    - [   -0.0014333292781391,    0.0073676753188474,    0.0066077929429179 ]    - [    0.0024480861966516,    0.0047100279783841,    0.0084748162467751 ]    - [   -0.0057460932003179,    0.0064558462330984,   -0.0050303540976604 ]    - [   -0.0035705925354605,   -0.0012442345652060,    0.0092575779387732 ]    - [   -0.0085176477712272,    0.0050708535014587,    0.0013176195247689 ]    - [    0.0076474481560943,   -0.0050480049578195,    0.0040042705510092 ]    - [   -0.0075723364753549,    0.0061636458060193,    0.0021608310165189 ]    - [    0.0050508293014761,    0.0084175477003859,    0.0019063090198282 ]    - [   -0.0058015584822404,    0.0008611720431674,   -0.0080994013290620 ]    - [   -0.0003763686805723,   -0.0099113934310291,   -0.0012738237207865 ]    - [   -0.0040313985400579,    0.0047776062907270,    0.0078052741106271 ]  - # 2    - [    0.0005156382200173,    0.0071874494254900,   -0.0069335912759609 ]    - [   -0.0079731483410977,   -0.0006922890092676,    0.0059958019862649 ]    - [   -0.0075906772708413,   -0.0063731208313308,   -0.0013285139966109 ]    - 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[   -0.0015754113534381,   -0.0050591792001018,   -0.0084807302096409 ]    - [    0.0045377619777847,   -0.0074229692324736,    0.0049303391370901 ]    - [    0.0053994417669662,   -0.0037751315963516,    0.0075229256300570 ]    - [   -0.0016030839200393,    0.0096660836810169,    0.0019992369086457 ]    - [    0.0044528695355816,    0.0027990477258329,    0.0085051328459701 ]    - [    0.0008234036102303,    0.0052586810951196,   -0.0084657119980833 ]  - # 5    - [    0.0008499995432390,    0.0085342280623120,    0.0051424169567373 ]    - [    0.0061305188574014,    0.0078931523660843,    0.0003389458139929 ]    - [    0.0087273518880870,   -0.0043757110635674,    0.0021648283326116 ]    - [   -0.0042654326174114,    0.0033498792134260,   -0.0084014518889165 ]    - [    0.0065900519472129,    0.0000851856735140,    0.0075209014575424 ]    - [   -0.0064825075645207,   -0.0028720765112696,    0.0070518275779648 ]    - [   -0.0012589590252604,    0.0098714522646186,    0.0009846077188768 ]    - 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[    0.0019183762131225,   -0.0035066544700857,   -0.0091664173553441 ]    - [   -0.0066290747061844,   -0.0057849128622113,   -0.0047529098157285 ]    - [    0.0074471441117511,   -0.0060924438196457,   -0.0027243665104518 ]    - [    0.0093306448832014,   -0.0032526917795396,   -0.0015359239079145 ]    - [   -0.0045563099721172,    0.0067491202860230,   -0.0058042583335666 ]    - [    0.0079680838893316,   -0.0042826841273152,   -0.0042624236999877 ]    - [    0.0080762179127324,   -0.0025503757849966,    0.0053169810589623 ]    - [   -0.0064920554923397,   -0.0018359559645781,    0.0073812249105763 ]  - # 10    - [    0.0068197500879292,   -0.0068352661513129,    0.0026019503029276 ]    - [   -0.0058434438508008,   -0.0005561551884640,    0.0080959777277907 ]    - [    0.0077514378946460,   -0.0005597568130649,    0.0062930026915356 ]    - [    0.0070789525604106,    0.0070493283296617,   -0.0004420415682767 ]    - [    0.0081809810189949,    0.0056786926479735,    0.0009077441141078 ]    - 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[    0.0068330690710376,    0.0029217673855692,   -0.0066912212947304 ]    - [   -0.0093250658973807,    0.0031144747950749,   -0.0018284399799696 ]    - [    0.0071850876754988,    0.0066064225442497,    0.0021747864865832 ]    - [   -0.0017321328677214,   -0.0077334117305094,   -0.0060986931989549 ]    - [   -0.0093559761481010,   -0.0005882382547991,    0.0034813339500479 ]  forces:  - # 1    - [   -0.0049724872334306,   -0.0230067763530277,    0.0464156023856426 ]    - [    0.0114791324164821,    0.0065045422870526,   -0.0347464004260197 ]    - [    0.0056321429334548,    0.0200554588256689,   -0.0269793490770883 ]    - [   -0.0285167115143129,   -0.0185889318131530,    0.0247304398616781 ]    - [    0.0272045708716343,   -0.0604405218053219,   -0.0427557561334486 ]    - [   -0.0168791260517756,   -0.0373301180758143,   -0.0014795882271388 ]    - [    0.0079231155735630,   -0.0094189387781249,    0.0132989675566713 ]    - [   -0.0111683458975752,   -0.0008458037123592,   -0.0328845031150835 ]    - 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[   -0.0259840451494939,    0.0074932129511960,    0.0373153631520994 ]    - [    0.0079366678065664,   -0.0099281518581773,   -0.0581700489629243 ]    - [   -0.0472808286881362,   -0.0559555445261985,   -0.0297082455575879 ]    - [    0.0542374628493900,    0.0485017261510675,   -0.0309498944180380 ]    - [    0.0497416790112883,   -0.0232295131432593,    0.0132810115893300 ]    - [   -0.0011589828817394,   -0.0334472395323916,   -0.0372862019111925 ]    - [   -0.0417398407946441,   -0.0238430367660214,   -0.0001847713821181 ]    - [    0.0270207944494720,   -0.0231501910837494,    0.0385859426675276 ]    - [    0.0259199323476821,   -0.0431995432603636,   -0.0125301781634985 ]    - [   -0.0421223187455491,    0.0004850121858843,    0.0778204954925184 ]    - [    0.0244900396471305,    0.0308262295116036,   -0.0044536016459147 ]    - [    0.0161765600126933,   -0.0420864631109174,    0.0072355580952551 ]    - [    0.0377222483024879,   -0.0392414940680212,   -0.0047092575467814 ]    - [   -0.0160328462776678,   -0.0613332749032309,    0.0461550317670891 ]    - [   -0.0059885040373792,    0.0167284044528252,   -0.0527151312362385 ]    - [    0.0261139541336679,    0.0228623242871417,   -0.0130318139625685 ]    - [   -0.0835223599219670,    0.0505668718632699,    0.0194415696483245 ]    - [    0.0339571445978169,   -0.0535552868097650,    0.0039122902006613 ]    - [   -0.0086152877786003,   -0.0292207283549075,   -0.0252385744905007 ]    - [   -0.0111734071116753,    0.0117035970926595,   -0.0155689375389181 ]    - [    0.0209292146043972,   -0.0082939852861406,    0.0363424938775751 ]    - [   -0.0383789490777738,    0.0275633688471970,   -0.0220158591417167 ]    - [    0.0294870985961956,    0.0453701865824876,   -0.0053790330745134 ]    - [    0.0361984024188373,   -0.0556354471188332,   -0.0279450654030071 ]    - [   -0.0141170723935106,   -0.0424176402806773,   -0.0111552253614804 ]    - [    0.0440574903520767,   -0.0265616482298510,    0.0129831930496286 ]    - [    0.0326878242590945,    0.0137989115113225,   -0.0429812621379749 ]    - [    0.0531998600274755,   -0.0381263047973141,   -0.0214470309309980 ]    - [   -0.0423072608041598,    0.0256498480381907,   -0.0346654938289407 ]    - [    0.0480988035935336,   -0.0363174692259671,   -0.0266414534637010 ]    - [   -0.0039394267002366,   -0.0348845760532755,   -0.0383353492742306 ]    - [    0.0115326263914287,    0.0126778878176910,    0.0819284295742033 ]    - [    0.0020101726842387,    0.0437332497529552,    0.0437113413971290 ]    - [    0.0288184507857585,   -0.0275391041633058,   -0.0560413505318958 ]  - # 2    - [    0.0064977578523797,   -0.0287536486424861,    0.0463632851831656 ]    - [    0.0152961083201332,    0.0033193624761702,   -0.0222848638721098 ]    - [    0.0336254196491802,    0.0239472749776113,    0.0440191341106354 ]    - [    0.0286556494372355,   -0.0392485725602807,   -0.0342083721163560 ]    - [   -0.0338830354586479,    0.0527138911902297,    0.0086559566880801 ]    - [    0.0729503878546881,    0.0360257203971715,    0.0227469514430560 ]    - [    0.0034076912816721,    0.0509757100485447,   -0.0114834761074206 ]    - [   -0.0451963110478081,    0.0000646682692874,    0.0003656324758522 ]    - [    0.0003705702199401,    0.0222522463399052,   -0.0142598502992429 ]    - [    0.0495923812531508,   -0.0067107731769834,   -0.0281696656431801 ]    - [   -0.0383900226271618,   -0.0096985005648802,   -0.0083163607814034 ]    - [   -0.0018126221534804,    0.0020624852068742,    0.0253682695762392 ]    - [   -0.0164262639334703,   -0.0086101502661159,    0.0230655544452133 ]    - [    0.0021579467723584,    0.0274222370166746,    0.0302127012338081 ]    - [   -0.0053884245540773,   -0.0143440310512664,   -0.0095779888737825 ]    - [    0.0313398202134643,   -0.0222733437234643,    0.0093749728483498 ]    - [    0.0127378880760872,    0.0010739311926351,    0.0292107468192532 ]    - [    0.0192291077106979,   -0.0237011266943335,    0.0425960943352122 ]    - 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[    0.0581687442011284,   -0.0351109666461897,    0.0268805352983235 ]  - # 4    - [    0.0097785774947997,    0.0179531451533089,    0.0658286721747550 ]    - [    0.0220946833689158,    0.0266213343479509,    0.0503868252400461 ]    - [    0.0063804581881566,   -0.0351217626395210,    0.0259926845738921 ]    - [   -0.0273957817232870,    0.0025527007508646,   -0.0454314336807030 ]    - [    0.0028420790321485,   -0.0185754973901222,   -0.0726249822469509 ]    - [   -0.0743349315631623,    0.0084259859715628,    0.0067373282329682 ]    - [   -0.0068571850202134,   -0.0209324559396754,   -0.0516362655708603 ]    - [    0.0274543964558999,    0.0235157541416696,    0.0311773009088548 ]    - [    0.0116964976747479,   -0.0160702390670174,    0.0139638447981147 ]    - [    0.0041635694763417,   -0.0272488980919156,    0.0094930025625986 ]    - [   -0.0006784183198123,   -0.0314269161266790,   -0.0323914924251075 ]    - [   -0.0530319950430292,    0.0006679983311027,   -0.0096631554804479 ]    - 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[   -0.0153329609565966,   -0.0035208492119458,   -0.0502222595967801 ]    - [    0.0709024716215033,    0.0208504937954876,    0.0242338192048895 ]    - [    0.1056796405498720,   -0.0180667694863706,   -0.0009913527603706 ]    - [   -0.1022805893421832,    0.0038481965617438,   -0.0041650294198382 ]    - [    0.0431185047422969,    0.0100758643141357,   -0.0178817088122125 ]    - [   -0.0495866415540002,   -0.0174874744483217,   -0.0340486408267432 ]    - [   -0.0337529853402746,    0.0058384620641828,    0.0308351686201907 ]    - [   -0.0451456408649986,    0.0207955888840041,    0.0459145219155023 ]    - [   -0.0144818475832620,    0.0401006801325767,    0.0065146768149041 ]    - [    0.0252390558482428,   -0.0189659980391182,   -0.0633006144441604 ]  - # 7    - [    0.0111868655850026,    0.0503295726138733,   -0.0129395951098712 ]    - [   -0.0312679349517439,   -0.0322962046086997,   -0.0682947867700820 ]    - [    0.0407758343472074,    0.0254247207469996,    0.0412957884960009 ]    - 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[   -0.0623287405600452,   -0.0252250489140076,    0.0158304654072587 ]  - # 17    - [   -0.0500229853575888,    0.0134061443384086,   -0.0170549358928319 ]    - [    0.0245677478595710,   -0.0008463116616207,    0.0494170626085814 ]    - [   -0.0004942415797595,    0.0334866276562989,    0.0523300585608764 ]    - [   -0.0134851956224538,   -0.0359463418636090,   -0.0027619289388829 ]    - [    0.0051954451563576,   -0.0503817691467255,   -0.0531879782601142 ]    - [    0.0114956206051094,   -0.0448038786088237,    0.0176670861994055 ]    - [    0.0180912337448843,   -0.0156782029889609,    0.0067062745280048 ]    - [   -0.0444529960333163,   -0.0169351848465298,    0.0232958126869912 ]    - [    0.0539033250400969,    0.0113436623321230,   -0.0023155719856848 ]    - [   -0.0346853702011156,   -0.0144825050151662,   -0.0050097682236027 ]    - [   -0.0354937170108350,    0.0123226141040465,   -0.0143532553855390 ]    - [    0.0304281701650733,    0.0372251678652537,   -0.0176385676596497 ]    - 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