action_type stringclasses 13
values | problem_id stringlengths 36 36 | mp_id stringlengths 6 10 | action_prompt stringlengths 39 448 | input stringlengths 1.11k 8.33k | output stringlengths 595 61.6k |
|---|---|---|---|---|---|
RotateAroundAtomAction | 0f9c02b4-7bab-4133-8d06-4804f581c8e0 | mp-1198663 | Rotate all surrounding atoms within 3.905 angstrom of the center atom at index 27 by 105.341 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K8Li4H24N12
_chemical_formula_sum "K8 Li4 H24 N12"
_cell_length_a 7.004138
_cell_length_b 7.004138
_cell_length_c 12.005835
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... | data_image0
_chemical_formula_structural K8Li4H24N12
_chemical_formula_sum "K8 Li4 H24 N12"
_cell_length_a 7.004138
_cell_length_b 7.004138
_cell_length_c 12.005835
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RotateAroundAtomAction | 53529f01-d61b-47b2-9be8-45989773a01c | mp-758066 | Rotate all surrounding atoms within 3.731 angstrom of the center atom at index 18 by 83.559 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li4V6P8O28
_chemical_formula_sum "Li4 V6 P8 O28"
_cell_length_a 5.338507
_cell_length_b 6.625273469999999
_cell_length_c 16.03223444
_cell_angle_alpha 81.67600264000001
_cell_angle_beta 83.46847737
_cell_angle_gamma 72.26610188
_sp... | data_image0
_chemical_formula_structural Li4V6P8O28
_chemical_formula_sum "Li4 V6 P8 O28"
_cell_length_a 5.338507
_cell_length_b 6.625273469999999
_cell_length_c 16.03223444
_cell_angle_alpha 81.67600264000001
_cell_angle_beta 83.46847737
_cell_angle_gamma 72.26610188
_sp... |
RotateAroundAtomAction | a69ab54d-3915-4436-98ab-bbebe9d0c1b3 | mp-753702 | Rotate all surrounding atoms within 1.89 angstrom of the center atom at index 17 by 121.05 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li4V4Si4O16
_chemical_formula_sum "Li4 V4 Si4 O16"
_cell_length_a 4.97352403
_cell_length_b 9.243516709999998
_cell_length_c 6.241561
_cell_angle_alpha 89.99882645000001
_cell_angle_beta 90.00073469
_cell_angle_gamma 97.01219666
_s... | data_image0
_chemical_formula_structural Li4V4Si4O16
_chemical_formula_sum "Li4 V4 Si4 O16"
_cell_length_a 4.97352403
_cell_length_b 9.243516709999998
_cell_length_c 6.241561
_cell_angle_alpha 89.99882645000001
_cell_angle_beta 90.00073469
_cell_angle_gamma 97.01219666
_s... |
RotateAroundAtomAction | 687c30df-fb11-478e-8bdf-5b24043ae773 | mp-696283 | Rotate all surrounding atoms within 2.59 angstrom of the center atom at index 14 by 100.348 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural H8S8N12O2
_chemical_formula_sum "H8 S8 N12 O2"
_cell_length_a 9.61511318
_cell_length_b 9.61511318
_cell_length_c 7.09981812
_cell_angle_alpha 75.06927197
_cell_angle_beta 75.06927197
_cell_angle_gamma 38.50693212
_space_group_name... | data_image0
_chemical_formula_structural H8S8N12O2
_chemical_formula_sum "H8 S8 N12 O2"
_cell_length_a 9.61511318
_cell_length_b 9.61511318
_cell_length_c 7.09981812
_cell_angle_alpha 75.06927197
_cell_angle_beta 75.06927197
_cell_angle_gamma 38.50693212
_space_group_name... |
RotateAroundAtomAction | 30d52799-b57c-4f23-aca8-72421c52c043 | mp-1096809 | Rotate all surrounding atoms within 3.246 angstrom of the center atom at index 17 by 301.644 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Al8Zn4S16
_chemical_formula_sum "Al8 Zn4 S16"
_cell_length_a 5.910544
_cell_length_b 7.22181
_cell_length_c 12.474986
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... | data_image0
_chemical_formula_structural Al8Zn4S16
_chemical_formula_sum "Al8 Zn4 S16"
_cell_length_a 5.910544
_cell_length_b 7.22181
_cell_length_c 12.474986
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... |
RotateAroundAtomAction | f9cbc94f-5db0-47dd-9012-4db591faeaff | mp-754713 | Rotate all surrounding atoms within 2.21 angstrom of the center atom at index 14 by 99.114 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Al8Cr4O20
_chemical_formula_sum "Al8 Cr4 O20"
_cell_length_a 5.05828776
_cell_length_b 7.185476969999999
_cell_length_c 10.24938235
_cell_angle_alpha 74.62419369000001
_cell_angle_beta 82.79878355
_cell_angle_gamma 110.2480265400000... | data_image0
_chemical_formula_structural Al8Cr4O20
_chemical_formula_sum "Al8 Cr4 O20"
_cell_length_a 5.05828776
_cell_length_b 7.185476969999999
_cell_length_c 10.24938235
_cell_angle_alpha 74.62419369000001
_cell_angle_beta 82.79878355
_cell_angle_gamma 110.2480265400000... |
RotateAroundAtomAction | 8a6348f4-e55e-4379-adc0-cd0538a8d880 | mp-2240560 | Rotate all surrounding atoms within 3.173 angstrom of the center atom at index 3 by 176.303 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural MgTiCo2O6
_chemical_formula_sum "Mg1 Ti1 Co2 O6"
_cell_length_a 6.73686587
_cell_length_b 3.0145380700000004
_cell_length_c 5.8034589599999995
_cell_angle_alpha 75.93404697
_cell_angle_beta 104.75206637
_cell_angle_gamma 89.44645409... | data_image0
_chemical_formula_structural MgTiCo2O6
_chemical_formula_sum "Mg1 Ti1 Co2 O6"
_cell_length_a 6.73686587
_cell_length_b 3.0145380700000004
_cell_length_c 5.8034589599999995
_cell_angle_alpha 75.93404697
_cell_angle_beta 104.75206637
_cell_angle_gamma 89.44645409... |
RotateAroundAtomAction | 8d47f20c-213c-4dd4-85b7-3acb2ace8cfc | mp-1320208 | Rotate all surrounding atoms within 2.347 angstrom of the center atom at index 9 by 85.85 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ba4Y2Cr6O14
_chemical_formula_sum "Ba4 Y2 Cr6 O14"
_cell_length_a 5.62234459
_cell_length_b 12.448562939999999
_cell_length_c 5.6223467
_cell_angle_alpha 102.69537061
_cell_angle_beta 91.54529385000001
_cell_angle_gamma 102.69469371... | data_image0
_chemical_formula_structural Ba4Y2Cr6O14
_chemical_formula_sum "Ba4 Y2 Cr6 O14"
_cell_length_a 5.62234459
_cell_length_b 12.448562939999999
_cell_length_c 5.6223467
_cell_angle_alpha 102.69537061
_cell_angle_beta 91.54529385000001
_cell_angle_gamma 102.69469371... |
RotateAroundAtomAction | 6bbac1ac-d4f7-4607-a8d6-e1e0cf821912 | mp-556409 | Rotate all surrounding atoms within 2.986 angstrom of the center atom at index 9 by 95.247 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ba7Ca2Mn5O20
_chemical_formula_sum "Ba7 Ca2 Mn5 O20"
_cell_length_a 17.75532635
_cell_length_b 17.75532635
_cell_length_c 17.75532621
_cell_angle_alpha 19.146729829999988
_cell_angle_beta 19.146729830000023
_cell_angle_gamma 19.1467... | data_image0
_chemical_formula_structural Ba7Ca2Mn5O20
_chemical_formula_sum "Ba7 Ca2 Mn5 O20"
_cell_length_a 17.75532635
_cell_length_b 17.75532635
_cell_length_c 17.75532621
_cell_angle_alpha 19.146729829999988
_cell_angle_beta 19.146729830000023
_cell_angle_gamma 19.1467... |
RotateAroundAtomAction | dfe23530-5249-422d-9714-cfd695e37d65 | mp-768771 | Rotate all surrounding atoms within 1.646 angstrom of the center atom at index 26 by 228.83 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li12Bi4B8O24
_chemical_formula_sum "Li12 Bi4 B8 O24"
_cell_length_a 9.188294
_cell_length_b 5.32128
_cell_length_c 12.005007730000003
_cell_angle_alpha 65.01187173
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... | data_image0
_chemical_formula_structural Li12Bi4B8O24
_chemical_formula_sum "Li12 Bi4 B8 O24"
_cell_length_a 9.188294
_cell_length_b 5.32128
_cell_length_c 12.005007730000003
_cell_angle_alpha 65.01187173
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... |
RotateAroundAtomAction | bc5a16fe-1bc6-4326-bea2-be72c2092008 | mp-1377792 | Rotate all surrounding atoms within 3.683 angstrom of the center atom at index 1 by 172.673 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Mg4V2Ir2O12
_chemical_formula_sum "Mg4 V2 Ir2 O12"
_cell_length_a 5.275469
_cell_length_b 5.115261
_cell_length_c 9.03851202
_cell_angle_alpha 55.72667628
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Mg4V2Ir2O12
_chemical_formula_sum "Mg4 V2 Ir2 O12"
_cell_length_a 5.275469
_cell_length_b 5.115261
_cell_length_c 9.03851202
_cell_angle_alpha 55.72667628
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RotateAroundAtomAction | 165c2fe5-5d8a-4c35-a56f-f7ae7a9c804e | mp-764815 | Rotate all surrounding atoms within 2.176 angstrom of the center atom at index 38 by 154.777 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li3Fe8B8O24
_chemical_formula_sum "Li3 Fe8 B8 O24"
_cell_length_a 5.255842
_cell_length_b 5.27095882
_cell_length_c 20.07931436
_cell_angle_alpha 90.31009899
_cell_angle_beta 90.40631797
_cell_angle_gamma 119.25181349
_space_group_... | data_image0
_chemical_formula_structural Li3Fe8B8O24
_chemical_formula_sum "Li3 Fe8 B8 O24"
_cell_length_a 5.255842
_cell_length_b 5.27095882
_cell_length_c 20.07931436
_cell_angle_alpha 90.31009899
_cell_angle_beta 90.40631797
_cell_angle_gamma 119.25181349
_space_group_... |
RotateAroundAtomAction | fc3e0288-121c-4eab-be5d-006113f9a8ab | mp-3887 | Rotate all surrounding atoms within 2.737 angstrom of the center atom at index 44 by 107.652 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li24Ga8N16
_chemical_formula_sum "Li24 Ga8 N16"
_cell_length_a 8.28699076
_cell_length_b 8.28700506
_cell_length_c 8.2869912
_cell_angle_alpha 109.47035236
_cell_angle_beta 109.47043864999999
_cell_angle_gamma 109.47038533000001
_s... | data_image0
_chemical_formula_structural Li24Ga8N16
_chemical_formula_sum "Li24 Ga8 N16"
_cell_length_a 8.28699076
_cell_length_b 8.28700506
_cell_length_c 8.2869912
_cell_angle_alpha 109.47035236
_cell_angle_beta 109.47043864999999
_cell_angle_gamma 109.47038533000001
_s... |
RotateAroundAtomAction | a4cecb09-1a03-418d-8f7f-f153cdcf8b50 | mp-1210568 | Rotate all surrounding atoms within 3.788 angstrom of the center atom at index 16 by 145.202 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Lu12Co4Sn2
_chemical_formula_sum "Lu12 Co4 Sn2"
_cell_length_a 8.12214077
_cell_length_b 8.12212615
_cell_length_c 8.12215372
_cell_angle_alpha 111.34907923
_cell_angle_beta 109.57515188
_cell_angle_gamma 107.51213659
_space_group_... | data_image0
_chemical_formula_structural Lu12Co4Sn2
_chemical_formula_sum "Lu12 Co4 Sn2"
_cell_length_a 8.12214077
_cell_length_b 8.12212615
_cell_length_c 8.12215372
_cell_angle_alpha 111.34907923
_cell_angle_beta 109.57515188
_cell_angle_gamma 107.51213659
_space_group_... |
RotateAroundAtomAction | 4cb5f4f2-dee8-46d9-9d53-21e593288d6a | mp-1356795 | Rotate all surrounding atoms within 2.839 angstrom of the center atom at index 9 by 107.523 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Zn6Bi4P4O24
_chemical_formula_sum "Zn6 Bi4 P4 O24"
_cell_length_a 5.253354
_cell_length_b 7.938561
_cell_length_c 12.044391
_cell_angle_alpha 88.87129292
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural Zn6Bi4P4O24
_chemical_formula_sum "Zn6 Bi4 P4 O24"
_cell_length_a 5.253354
_cell_length_b 7.938561
_cell_length_c 12.044391
_cell_angle_alpha 88.87129292
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
RotateAroundAtomAction | 82b10862-9903-4660-8a72-001d9b46bd81 | mp-1027815 | Rotate all surrounding atoms within 3.552 angstrom of the center atom at index 12 by 154.08 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural KMg14Co
_chemical_formula_sum "K1 Mg14 Co1"
_cell_length_a 6.33349415
_cell_length_b 6.33349365
_cell_length_c 10.48663987
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000266
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural KMg14Co
_chemical_formula_sum "K1 Mg14 Co1"
_cell_length_a 6.33349415
_cell_length_b 6.33349365
_cell_length_c 10.48663987
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000266
_space_group_name_H-M_alt "P ... |
RotateAroundAtomAction | 4b2a3a50-4e63-47f0-834c-1c74f026addb | mp-18292 | Rotate all surrounding atoms within 3.294 angstrom of the center atom at index 10 by 225.412 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural La8Mn2S12O2
_chemical_formula_sum "La8 Mn2 S12 O2"
_cell_length_a 9.5080546
_cell_length_b 9.5080546
_cell_length_c 6.865941
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000419000001
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural La8Mn2S12O2
_chemical_formula_sum "La8 Mn2 S12 O2"
_cell_length_a 9.5080546
_cell_length_b 9.5080546
_cell_length_c 6.865941
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000419000001
_space_group_name_H-M_al... |
RotateAroundAtomAction | 3822dc81-7e49-41df-a1c2-0a4412e4357c | mp-1210133 | Rotate all surrounding atoms within 2.711 angstrom of the center atom at index 24 by 91.409 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na4Ga4P8O28
_chemical_formula_sum "Na4 Ga4 P8 O28"
_cell_length_a 7.923065
_cell_length_b 7.374088
_cell_length_c 9.57433286
_cell_angle_alpha 67.84418012
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Na4Ga4P8O28
_chemical_formula_sum "Na4 Ga4 P8 O28"
_cell_length_a 7.923065
_cell_length_b 7.374088
_cell_length_c 9.57433286
_cell_angle_alpha 67.84418012
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RotateAroundAtomAction | 43e61c54-cf2d-4619-9ea7-0fd589d11626 | mp-1233053 | Rotate all surrounding atoms within 2.814 angstrom of the center atom at index 11 by 51.911 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural MgV8O8F8
_chemical_formula_sum "Mg1 V8 O8 F8"
_cell_length_a 4.92631587
_cell_length_b 10.52289636
_cell_length_c 5.74835096
_cell_angle_alpha 85.04993622000002
_cell_angle_beta 95.09364485
_cell_angle_gamma 90.56101114
_space_grou... | data_image0
_chemical_formula_structural MgV8O8F8
_chemical_formula_sum "Mg1 V8 O8 F8"
_cell_length_a 4.92631587
_cell_length_b 10.52289636
_cell_length_c 5.74835096
_cell_angle_alpha 85.04993622000002
_cell_angle_beta 95.09364485
_cell_angle_gamma 90.56101114
_space_grou... |
RotateAroundAtomAction | cbadc606-1645-41f1-8e6e-94a60f0a4150 | mp-27888 | Rotate all surrounding atoms within 3.182 angstrom of the center atom at index 2 by 271.457 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Zr3GeO8
_chemical_formula_sum "Zr3 Ge1 O8"
_cell_length_a 5.01459289
_cell_length_b 5.01458845
_cell_length_c 6.33418319
_cell_angle_alpha 113.31969382
_cell_angle_beta 113.32013782
_cell_angle_gamma 90.00120143000001
_space_group_... | data_image0
_chemical_formula_structural Zr3GeO8
_chemical_formula_sum "Zr3 Ge1 O8"
_cell_length_a 5.01459289
_cell_length_b 5.01458845
_cell_length_c 6.33418319
_cell_angle_alpha 113.31969382
_cell_angle_beta 113.32013782
_cell_angle_gamma 90.00120143000001
_space_group_... |
RotateAroundAtomAction | 9da69e9e-aade-42e2-b699-4cf42ffb726a | mp-1176929 | Rotate all surrounding atoms within 1.749 angstrom of the center atom at index 56 by 197.53 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li12V6P16O58
_chemical_formula_sum "Li12 V6 P16 O58"
_cell_length_a 9.79348461
_cell_length_b 9.79581916
_cell_length_c 14.06576449
_cell_angle_alpha 90.95621213000001
_cell_angle_beta 90.88902406
_cell_angle_gamma 60.31136227000000... | data_image0
_chemical_formula_structural Li12V6P16O58
_chemical_formula_sum "Li12 V6 P16 O58"
_cell_length_a 9.79348461
_cell_length_b 9.79581916
_cell_length_c 14.06576449
_cell_angle_alpha 90.95621213000001
_cell_angle_beta 90.88902406
_cell_angle_gamma 60.31136227000000... |
RotateAroundAtomAction | 39e71c56-ff8f-472e-a9ed-76b311812c54 | mp-639682 | Rotate all surrounding atoms within 2.435 angstrom of the center atom at index 15 by 97.157 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Si10O20
_chemical_formula_sum "Si10 O20"
_cell_length_a 7.19367919
_cell_length_b 7.19367919
_cell_length_c 12.12717244
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_g... | data_image0
_chemical_formula_structural Si10O20
_chemical_formula_sum "Si10 O20"
_cell_length_a 7.19367919
_cell_length_b 7.19367919
_cell_length_c 12.12717244
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_g... |
RotateAroundAtomAction | 0c8d3ed7-b19d-4448-bc1d-6ab4c85374ca | mp-757139 | Rotate all surrounding atoms within 3.479 angstrom of the center atom at index 1 by 143.113 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li6TiMn3P6O24
_chemical_formula_sum "Li6 Ti1 Mn3 P6 O24"
_cell_length_a 8.620037
_cell_length_b 8.65660093
_cell_length_c 8.76631981
_cell_angle_alpha 61.44259836
_cell_angle_beta 61.38097025
_cell_angle_gamma 61.406440620000005
_s... | data_image0
_chemical_formula_structural Li6TiMn3P6O24
_chemical_formula_sum "Li6 Ti1 Mn3 P6 O24"
_cell_length_a 8.620037
_cell_length_b 8.65660093
_cell_length_c 8.76631981
_cell_angle_alpha 61.44259836
_cell_angle_beta 61.38097025
_cell_angle_gamma 61.406440620000005
_s... |
RotateAroundAtomAction | 4fb6c93d-22fa-46fb-aaaa-5c9659132609 | mp-1099221 | Rotate all surrounding atoms within 3.523 angstrom of the center atom at index 0 by 222.153 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural CsMg6BO7
_chemical_formula_sum "Cs1 Mg6 B1 O7"
_cell_length_a 4.876208
_cell_length_b 4.876208
_cell_length_c 7.931088
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gr... | data_image0
_chemical_formula_structural CsMg6BO7
_chemical_formula_sum "Cs1 Mg6 B1 O7"
_cell_length_a 4.876208
_cell_length_b 4.876208
_cell_length_c 7.931088
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gr... |
RotateAroundAtomAction | 41ce7556-b709-4956-988c-960a1229f2a5 | mp-1043461 | Rotate all surrounding atoms within 2.292 angstrom of the center atom at index 13 by 206.146 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ni4Sb4P8O36
_chemical_formula_sum "Ni4 Sb4 P8 O36"
_cell_length_a 6.398521
_cell_length_b 7.881027
_cell_length_c 14.069832
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... | data_image0
_chemical_formula_structural Ni4Sb4P8O36
_chemical_formula_sum "Ni4 Sb4 P8 O36"
_cell_length_a 6.398521
_cell_length_b 7.881027
_cell_length_c 14.069832
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RotateAroundAtomAction | 1c95795e-8e32-49a5-911b-f11940ec1380 | mp-2231769 | Rotate all surrounding atoms within 2.849 angstrom of the center atom at index 13 by 61.179 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural MgMn2Se4O12
_chemical_formula_sum "Mg1 Mn2 Se4 O12"
_cell_length_a 5.44462449
_cell_length_b 6.89465889
_cell_length_c 7.89161823
_cell_angle_alpha 88.69789064999999
_cell_angle_beta 93.2494109
_cell_angle_gamma 83.75586802
_space_... | data_image0
_chemical_formula_structural MgMn2Se4O12
_chemical_formula_sum "Mg1 Mn2 Se4 O12"
_cell_length_a 5.44462449
_cell_length_b 6.89465889
_cell_length_c 7.89161823
_cell_angle_alpha 88.69789064999999
_cell_angle_beta 93.2494109
_cell_angle_gamma 83.75586802
_space_... |
RotateAroundAtomAction | 6d922730-e0a4-4285-92bf-338b937a32c8 | mp-1213688 | Rotate all surrounding atoms within 3.662 angstrom of the center atom at index 14 by 268.72 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Cs4Ca4I12
_chemical_formula_sum "Cs4 Ca4 I12"
_cell_length_a 8.57588159
_cell_length_b 8.78260577
_cell_length_c 12.28814489
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... | data_image0
_chemical_formula_structural Cs4Ca4I12
_chemical_formula_sum "Cs4 Ca4 I12"
_cell_length_a 8.57588159
_cell_length_b 8.78260577
_cell_length_c 12.28814489
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... |
RotateAroundAtomAction | c0eae769-2345-4c9c-91dc-3b613af3d0a4 | mp-1227253 | Rotate all surrounding atoms within 3.45 angstrom of the center atom at index 10 by 97.749 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural CaU3Ti8O24
_chemical_formula_sum "Ca1 U3 Ti8 O24"
_cell_length_a 7.50474
_cell_length_b 7.85782394
_cell_length_c 8.45750307
_cell_angle_alpha 98.93237861
_cell_angle_beta 111.53004347
_cell_angle_gamma 94.83442283
_space_group_nam... | data_image0
_chemical_formula_structural CaU3Ti8O24
_chemical_formula_sum "Ca1 U3 Ti8 O24"
_cell_length_a 7.50474
_cell_length_b 7.85782394
_cell_length_c 8.45750307
_cell_angle_alpha 98.93237861
_cell_angle_beta 111.53004347
_cell_angle_gamma 94.83442283
_space_group_nam... |
RotateAroundAtomAction | 4fad72ea-dbe2-4848-8a8d-804d3f4f6eaa | mp-561179 | Rotate all surrounding atoms within 3.184 angstrom of the center atom at index 5 by 77.74 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ba8Cu4I4O8
_chemical_formula_sum "Ba8 Cu4 I4 O8"
_cell_length_a 4.44409499
_cell_length_b 11.08544927
_cell_length_c 14.130622020000002
_cell_angle_alpha 88.26392371999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_n... | data_image0
_chemical_formula_structural Ba8Cu4I4O8
_chemical_formula_sum "Ba8 Cu4 I4 O8"
_cell_length_a 4.44409499
_cell_length_b 11.08544927
_cell_length_c 14.130622020000002
_cell_angle_alpha 88.26392371999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_n... |
RotateAroundAtomAction | b2c2c5c9-b755-4549-b4bc-1f71bb644939 | mp-559041 | Rotate all surrounding atoms within 3.712 angstrom of the center atom at index 16 by 312.61 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Tl2Mo4Cl14O4
_chemical_formula_sum "Tl2 Mo4 Cl14 O4"
_cell_length_a 7.267019
_cell_length_b 9.62580344
_cell_length_c 10.28145424
_cell_angle_alpha 103.5128878
_cell_angle_beta 90.43926368
_cell_angle_gamma 109.13855377
_space_grou... | data_image0
_chemical_formula_structural Tl2Mo4Cl14O4
_chemical_formula_sum "Tl2 Mo4 Cl14 O4"
_cell_length_a 7.267019
_cell_length_b 9.62580344
_cell_length_c 10.28145424
_cell_angle_alpha 103.5128878
_cell_angle_beta 90.43926368
_cell_angle_gamma 109.13855377
_space_grou... |
RotateAroundAtomAction | ddd3ea93-3c52-4c6f-9e82-40885da0a6b1 | mp-761710 | Rotate all surrounding atoms within 2.085 angstrom of the center atom at index 12 by 81.527 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li2Fe2Co2O8
_chemical_formula_sum "Li2 Fe2 Co2 O8"
_cell_length_a 5.84785554
_cell_length_b 5.847855770000001
_cell_length_c 5.84785554
_cell_angle_alpha 89.97011905
_cell_angle_beta 119.157337
_cell_angle_gamma 59.184920010000006
... | data_image0
_chemical_formula_structural Li2Fe2Co2O8
_chemical_formula_sum "Li2 Fe2 Co2 O8"
_cell_length_a 5.84785554
_cell_length_b 5.847855770000001
_cell_length_c 5.84785554
_cell_angle_alpha 89.97011905
_cell_angle_beta 119.157337
_cell_angle_gamma 59.184920010000006
... |
RotateAroundAtomAction | fc9d3cbe-384b-4055-8241-73676b9adcc7 | mp-22385 | Rotate all surrounding atoms within 3.125 angstrom of the center atom at index 6 by 124.211 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural NpAl8Fe4
_chemical_formula_sum "Np1 Al8 Fe4"
_cell_length_a 6.67251209
_cell_length_b 6.67251209
_cell_length_c 6.67251209
_cell_angle_alpha 98.01214626999999
_cell_angle_beta 98.01214626999999
_cell_angle_gamma 136.15645146
_space... | data_image0
_chemical_formula_structural NpAl8Fe4
_chemical_formula_sum "Np1 Al8 Fe4"
_cell_length_a 6.67251209
_cell_length_b 6.67251209
_cell_length_c 6.67251209
_cell_angle_alpha 98.01214626999999
_cell_angle_beta 98.01214626999999
_cell_angle_gamma 136.15645146
_space... |
RotateAroundAtomAction | c33abe49-bbfd-4228-8b38-e26f0a9c9f6c | mp-2713621 | Rotate all surrounding atoms within 3.226 angstrom of the center atom at index 74 by 273.181 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na12Zr4Ti4Si8P4O48
_chemical_formula_sum "Na12 Zr4 Ti4 Si8 P4 O48"
_cell_length_a 15.70059751
_cell_length_b 9.08334196
_cell_length_c 9.0447651
_cell_angle_alpha 89.98724374000001
_cell_angle_beta 125.00184299
_cell_angle_gamma 90.... | data_image0
_chemical_formula_structural Na12Zr4Ti4Si8P4O48
_chemical_formula_sum "Na12 Zr4 Ti4 Si8 P4 O48"
_cell_length_a 15.70059751
_cell_length_b 9.08334196
_cell_length_c 9.0447651
_cell_angle_alpha 89.98724374000001
_cell_angle_beta 125.00184299
_cell_angle_gamma 90.... |
RotateAroundAtomAction | 516c40ed-7c43-4435-9d44-f41f6172880b | mp-759955 | Rotate all surrounding atoms within 3.175 angstrom of the center atom at index 39 by 101.509 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li12V8O16F8
_chemical_formula_sum "Li12 V8 O16 F8"
_cell_length_a 5.937069
_cell_length_b 6.03219996
_cell_length_c 15.07458003
_cell_angle_alpha 80.25103232000001
_cell_angle_beta 85.17375532
_cell_angle_gamma 60.75174218
_space_g... | data_image0
_chemical_formula_structural Li12V8O16F8
_chemical_formula_sum "Li12 V8 O16 F8"
_cell_length_a 5.937069
_cell_length_b 6.03219996
_cell_length_c 15.07458003
_cell_angle_alpha 80.25103232000001
_cell_angle_beta 85.17375532
_cell_angle_gamma 60.75174218
_space_g... |
RotateAroundAtomAction | 5ec598ae-b6cd-458d-a429-fec9f22598ad | mp-1377792 | Rotate all surrounding atoms within 3.358 angstrom of the center atom at index 6 by 249.946 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Mg4V2Ir2O12
_chemical_formula_sum "Mg4 V2 Ir2 O12"
_cell_length_a 5.275469
_cell_length_b 5.115261
_cell_length_c 9.03851202
_cell_angle_alpha 55.72667628
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Mg4V2Ir2O12
_chemical_formula_sum "Mg4 V2 Ir2 O12"
_cell_length_a 5.275469
_cell_length_b 5.115261
_cell_length_c 9.03851202
_cell_angle_alpha 55.72667628
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RotateAroundAtomAction | 5c4f569b-db86-4476-a808-2ee01b086d04 | mp-1174544 | Rotate all surrounding atoms within 3.418 angstrom of the center atom at index 26 by 232.917 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li8Mn2Co4O14
_chemical_formula_sum "Li8 Mn2 Co4 O14"
_cell_length_a 2.944711
_cell_length_b 5.1004160800000005
_cell_length_c 17.2736048
_cell_angle_alpha 95.32903194999999
_cell_angle_beta 88.82123337
_cell_angle_gamma 105.12908574... | data_image0
_chemical_formula_structural Li8Mn2Co4O14
_chemical_formula_sum "Li8 Mn2 Co4 O14"
_cell_length_a 2.944711
_cell_length_b 5.1004160800000005
_cell_length_c 17.2736048
_cell_angle_alpha 95.32903194999999
_cell_angle_beta 88.82123337
_cell_angle_gamma 105.12908574... |
RotateAroundAtomAction | 0ff7b4c3-ba25-4afb-888c-90b33d70da14 | mp-733581 | Rotate all surrounding atoms within 3.787 angstrom of the center atom at index 69 by 175.303 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Pr8H8Se16O48
_chemical_formula_sum "Pr8 H8 Se16 O48"
_cell_length_a 7.08154831
_cell_length_b 8.41853341
_cell_length_c 18.8842553
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural Pr8H8Se16O48
_chemical_formula_sum "Pr8 H8 Se16 O48"
_cell_length_a 7.08154831
_cell_length_b 8.41853341
_cell_length_c 18.8842553
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
RotateAroundAtomAction | 9790d1bd-93c0-4e55-bf17-4ecf5060cc81 | mp-532718 | Rotate all surrounding atoms within 3.711 angstrom of the center atom at index 34 by 260.991 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ca6Nd6Mn12O36
_chemical_formula_sum "Ca6 Nd6 Mn12 O36"
_cell_length_a 16.297216
_cell_length_b 5.473793
_cell_length_c 7.702508
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... | data_image0
_chemical_formula_structural Ca6Nd6Mn12O36
_chemical_formula_sum "Ca6 Nd6 Mn12 O36"
_cell_length_a 16.297216
_cell_length_b 5.473793
_cell_length_c 7.702508
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... |
RotateAroundAtomAction | f86151f5-e80c-499c-b965-ff547748fce8 | mp-756218 | Rotate all surrounding atoms within 2.972 angstrom of the center atom at index 9 by 172.467 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li2V2Cr2O8
_chemical_formula_sum "Li2 V2 Cr2 O8"
_cell_length_a 5.84010577
_cell_length_b 5.83504027
_cell_length_c 5.77845652
_cell_angle_alpha 91.6471868
_cell_angle_beta 120.44420644
_cell_angle_gamma 59.70630936
_space_group_na... | data_image0
_chemical_formula_structural Li2V2Cr2O8
_chemical_formula_sum "Li2 V2 Cr2 O8"
_cell_length_a 5.84010577
_cell_length_b 5.83504027
_cell_length_c 5.77845652
_cell_angle_alpha 91.6471868
_cell_angle_beta 120.44420644
_cell_angle_gamma 59.70630936
_space_group_na... |
RotateAroundAtomAction | 2f69ac34-6761-4afd-a3c0-85c041b3e86d | mp-23792 | Rotate all surrounding atoms within 1.91 angstrom of the center atom at index 22 by 160.39 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na2Ca4Si6H2O18
_chemical_formula_sum "Na2 Ca4 Si6 H2 O18"
_cell_length_a 7.090316
_cell_length_b 7.11624034
_cell_length_c 8.08561858
_cell_angle_alpha 95.22026963
_cell_angle_beta 102.41097799
_cell_angle_gamma 90.44883052999998
_... | data_image0
_chemical_formula_structural Na2Ca4Si6H2O18
_chemical_formula_sum "Na2 Ca4 Si6 H2 O18"
_cell_length_a 7.090316
_cell_length_b 7.11624034
_cell_length_c 8.08561858
_cell_angle_alpha 95.22026963
_cell_angle_beta 102.41097799
_cell_angle_gamma 90.44883052999998
_... |
RotateAroundAtomAction | 58f3e1d8-664f-43b7-9c99-e678479b7103 | mp-754356 | Rotate all surrounding atoms within 2.292 angstrom of the center atom at index 40 by 48.793 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na10Mn4P4C4O28
_chemical_formula_sum "Na10 Mn4 P4 C4 O28"
_cell_length_a 6.63058431
_cell_length_b 10.56808174
_cell_length_c 10.433935000000002
_cell_angle_alpha 119.59234913
_cell_angle_beta 88.81323704
_cell_angle_gamma 90.146987... | data_image0
_chemical_formula_structural Na10Mn4P4C4O28
_chemical_formula_sum "Na10 Mn4 P4 C4 O28"
_cell_length_a 6.63058431
_cell_length_b 10.56808174
_cell_length_c 10.433935000000002
_cell_angle_alpha 119.59234913
_cell_angle_beta 88.81323704
_cell_angle_gamma 90.146987... |
RotateAroundAtomAction | 767ecc09-1108-4375-b9ef-c099a33709f7 | mp-1213037 | Rotate all surrounding atoms within 3.454 angstrom of the center atom at index 0 by 211.097 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K4Li4As4
_chemical_formula_sum "K4 Li4 As4"
_cell_length_a 4.311587
_cell_length_b 12.867966
_cell_length_c 14.594449
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... | data_image0
_chemical_formula_structural K4Li4As4
_chemical_formula_sum "K4 Li4 As4"
_cell_length_a 4.311587
_cell_length_b 12.867966
_cell_length_c 14.594449
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... |
RotateAroundAtomAction | a08cdf2f-05dc-417e-b4d5-ab89412b4cff | mp-1193391 | Rotate all surrounding atoms within 2.143 angstrom of the center atom at index 5 by 127.788 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Co2P2N2O20
_chemical_formula_sum "Co2 P2 N2 O20"
_cell_length_a 7.846009
_cell_length_b 4.907373
_cell_length_c 12.329286
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... | data_image0
_chemical_formula_structural Co2P2N2O20
_chemical_formula_sum "Co2 P2 N2 O20"
_cell_length_a 7.846009
_cell_length_b 4.907373
_cell_length_c 12.329286
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... |
RotateAroundAtomAction | d98bba76-2eee-4df5-917d-b87bd6dff64a | mp-759392 | Rotate all surrounding atoms within 2.071 angstrom of the center atom at index 18 by 312.416 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li8Mn4F20
_chemical_formula_sum "Li8 Mn4 F20"
_cell_length_a 5.136198
_cell_length_b 7.41645
_cell_length_c 9.929168740000001
_cell_angle_alpha 70.28427604000001
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural Li8Mn4F20
_chemical_formula_sum "Li8 Mn4 F20"
_cell_length_a 5.136198
_cell_length_b 7.41645
_cell_length_c 9.929168740000001
_cell_angle_alpha 70.28427604000001
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_al... |
RotateAroundAtomAction | 60a09ecb-e133-4977-8d53-6ab89f54e91d | mp-755952 | Rotate all surrounding atoms within 2.847 angstrom of the center atom at index 4 by 309.114 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural VCu3P4O16
_chemical_formula_sum "V1 Cu3 P4 O16"
_cell_length_a 5.911984
_cell_length_b 4.853885
_cell_length_c 9.78967238
_cell_angle_alpha 89.39078934
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"... | data_image0
_chemical_formula_structural VCu3P4O16
_chemical_formula_sum "V1 Cu3 P4 O16"
_cell_length_a 5.911984
_cell_length_b 4.853885
_cell_length_c 9.78967238
_cell_angle_alpha 89.39078934
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"... |
RotateAroundAtomAction | 39e2c5af-a903-4c08-95dc-b5e09be541ef | mp-1172905 | Rotate all surrounding atoms within 3.421 angstrom of the center atom at index 7 by 107.582 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ag3Bi3S6
_chemical_formula_sum "Ag3 Bi3 S6"
_cell_length_a 4.04844097
_cell_length_b 4.04844097
_cell_length_c 19.110277
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001577
_space_group_name_H-M_alt "P 1"... | data_image0
_chemical_formula_structural Ag3Bi3S6
_chemical_formula_sum "Ag3 Bi3 S6"
_cell_length_a 4.04844097
_cell_length_b 4.04844097
_cell_length_c 19.110277
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001577
_space_group_name_H-M_alt "P 1"... |
RotateAroundAtomAction | 07e2a07b-b13f-4783-99e8-2c768c2866b0 | mp-1198564 | Rotate all surrounding atoms within 2.849 angstrom of the center atom at index 18 by 165.763 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Eu12Cu12Ge12
_chemical_formula_sum "Eu12 Cu12 Ge12"
_cell_length_a 4.500955
_cell_length_b 7.637562
_cell_length_c 22.479168
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... | data_image0
_chemical_formula_structural Eu12Cu12Ge12
_chemical_formula_sum "Eu12 Cu12 Ge12"
_cell_length_a 4.500955
_cell_length_b 7.637562
_cell_length_c 22.479168
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... |
RotateAroundAtomAction | e43639b3-9f8f-41e0-836d-e832436a49ba | mp-1033833 | Rotate all surrounding atoms within 3.326 angstrom of the center atom at index 10 by 125.94 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural CsRbMg6O7
_chemical_formula_sum "Cs1 Rb1 Mg6 O7"
_cell_length_a 8.01571157
_cell_length_b 5.11553541
_cell_length_c 5.115538539999999
_cell_angle_alpha 90.0
_cell_angle_beta 90.00000357
_cell_angle_gamma 89.99999846
_space_group_na... | data_image0
_chemical_formula_structural CsRbMg6O7
_chemical_formula_sum "Cs1 Rb1 Mg6 O7"
_cell_length_a 8.01571157
_cell_length_b 5.11553541
_cell_length_c 5.115538539999999
_cell_angle_alpha 90.0
_cell_angle_beta 90.00000357
_cell_angle_gamma 89.99999846
_space_group_na... |
RotateAroundAtomAction | 8675c043-0309-4b86-b899-c180c606c61c | mp-1220828 | Rotate all surrounding atoms within 2.873 angstrom of the center atom at index 48 by 136.754 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Nb16Pb12O48F8
_chemical_formula_sum "Nb16 Pb12 O48 F8"
_cell_length_a 12.91869857
_cell_length_b 12.91869857
_cell_length_c 7.584243
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.09828515000001
_space_group_name... | data_image0
_chemical_formula_structural Nb16Pb12O48F8
_chemical_formula_sum "Nb16 Pb12 O48 F8"
_cell_length_a 12.91869857
_cell_length_b 12.91869857
_cell_length_c 7.584243
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.09828515000001
_space_group_name... |
RotateAroundAtomAction | 95862d8b-e8b2-4e02-97f3-5553e4a15777 | mp-1197275 | Rotate all surrounding atoms within 2.631 angstrom of the center atom at index 13 by 50.863 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Tb8Fe56C4
_chemical_formula_sum "Tb8 Fe56 C4"
_cell_length_a 8.729041
_cell_length_b 8.729041
_cell_length_c 11.772369
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gr... | data_image0
_chemical_formula_structural Tb8Fe56C4
_chemical_formula_sum "Tb8 Fe56 C4"
_cell_length_a 8.729041
_cell_length_b 8.729041
_cell_length_c 11.772369
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gr... |
RotateAroundAtomAction | ab8bb9de-69e3-4d68-bf9b-52335a5326bd | mp-1039781 | Rotate all surrounding atoms within 3.395 angstrom of the center atom at index 59 by 281.097 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural NaMg30WO32
_chemical_formula_sum "Na1 Mg30 W1 O32"
_cell_length_a 8.565666
_cell_length_b 8.565666
_cell_length_c 8.56018
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... | data_image0
_chemical_formula_structural NaMg30WO32
_chemical_formula_sum "Na1 Mg30 W1 O32"
_cell_length_a 8.565666
_cell_length_b 8.565666
_cell_length_c 8.56018
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... |
RotateAroundAtomAction | 509b44d0-7e7d-4abe-80f3-152634e5df5d | mp-866658 | Rotate all surrounding atoms within 3.51 angstrom of the center atom at index 23 by 127.751 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural H16RhN5Cl6O3
_chemical_formula_sum "H16 Rh1 N5 Cl6 O3"
_cell_length_a 9.33784635
_cell_length_b 9.33784635
_cell_length_c 9.33784639
_cell_angle_alpha 43.55420994000001
_cell_angle_beta 43.55420994
_cell_angle_gamma 43.5542098099999... | data_image0
_chemical_formula_structural H16RhN5Cl6O3
_chemical_formula_sum "H16 Rh1 N5 Cl6 O3"
_cell_length_a 9.33784635
_cell_length_b 9.33784635
_cell_length_c 9.33784639
_cell_angle_alpha 43.55420994000001
_cell_angle_beta 43.55420994
_cell_angle_gamma 43.5542098099999... |
RotateAroundAtomAction | 6602094b-e18b-406c-8654-9fa3a0275dc6 | mp-1224552 | Rotate all surrounding atoms within 3.343 angstrom of the center atom at index 0 by 93.166 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ho4NiSn8
_chemical_formula_sum "Ho4 Ni1 Sn8"
_cell_length_a 4.390995
_cell_length_b 4.397435
_cell_length_c 16.888049
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... | data_image0
_chemical_formula_structural Ho4NiSn8
_chemical_formula_sum "Ho4 Ni1 Sn8"
_cell_length_a 4.390995
_cell_length_b 4.397435
_cell_length_c 16.888049
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... |
RotateAroundAtomAction | 56edd794-df60-47ef-9676-133d40dd85c5 | mp-1200515 | Rotate all surrounding atoms within 2.678 angstrom of the center atom at index 32 by 143.642 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Tb20Si16
_chemical_formula_sum "Tb20 Si16"
_cell_length_a 7.48899009
_cell_length_b 7.70841404
_cell_length_c 14.64288919
_cell_angle_alpha 90.00000779999999
_cell_angle_beta 90.00552247
_cell_angle_gamma 89.99549034
_space_group_n... | data_image0
_chemical_formula_structural Tb20Si16
_chemical_formula_sum "Tb20 Si16"
_cell_length_a 7.48899009
_cell_length_b 7.70841404
_cell_length_c 14.64288919
_cell_angle_alpha 90.00000779999999
_cell_angle_beta 90.00552247
_cell_angle_gamma 89.99549034
_space_group_n... |
RotateAroundAtomAction | ee5aafe6-c124-4a38-b544-2e051b5b8adc | mp-1205091 | Rotate all surrounding atoms within 3.407 angstrom of the center atom at index 14 by 50.627 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K4B24F24
_chemical_formula_sum "K4 B24 F24"
_cell_length_a 8.36979153
_cell_length_b 8.36979153
_cell_length_c 11.53401593
_cell_angle_alpha 88.54504346999998
_cell_angle_beta 88.54504346999998
_cell_angle_gamma 120.21922669999998
... | data_image0
_chemical_formula_structural K4B24F24
_chemical_formula_sum "K4 B24 F24"
_cell_length_a 8.36979153
_cell_length_b 8.36979153
_cell_length_c 11.53401593
_cell_angle_alpha 88.54504346999998
_cell_angle_beta 88.54504346999998
_cell_angle_gamma 120.21922669999998
... |
RotateAroundAtomAction | b263453a-66c3-4e4f-a872-c541b052804a | mp-621667 | Rotate all surrounding atoms within 3.88 angstrom of the center atom at index 1 by 289.171 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Eu6Ag4
_chemical_formula_sum "Eu6 Ag4"
_cell_length_a 4.3545106
_cell_length_b 8.43465072
_cell_length_c 8.43467834
_cell_angle_alpha 89.99643163
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... | data_image0
_chemical_formula_structural Eu6Ag4
_chemical_formula_sum "Eu6 Ag4"
_cell_length_a 4.3545106
_cell_length_b 8.43465072
_cell_length_c 8.43467834
_cell_angle_alpha 89.99643163
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... |
RotateAroundAtomAction | 3b2d2a31-250a-4cf5-84fb-2b6f4b7f5b5e | mp-1305321 | Rotate all surrounding atoms within 2.964 angstrom of the center atom at index 15 by 112.542 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li8Mn4O8F4
_chemical_formula_sum "Li8 Mn4 O8 F4"
_cell_length_a 3.05235613
_cell_length_b 14.693265340000002
_cell_length_c 5.06606481
_cell_angle_alpha 81.73800875
_cell_angle_beta 86.33348749
_cell_angle_gamma 86.62612284000001
_... | data_image0
_chemical_formula_structural Li8Mn4O8F4
_chemical_formula_sum "Li8 Mn4 O8 F4"
_cell_length_a 3.05235613
_cell_length_b 14.693265340000002
_cell_length_c 5.06606481
_cell_angle_alpha 81.73800875
_cell_angle_beta 86.33348749
_cell_angle_gamma 86.62612284000001
_... |
RotateAroundAtomAction | 15a2c7c1-171f-4237-8d60-28c99e4c8ce3 | mp-1042364 | Rotate all surrounding atoms within 3.83 angstrom of the center atom at index 50 by 275.465 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ca8Ta8Bi8O40
_chemical_formula_sum "Ca8 Ta8 Bi8 O40"
_cell_length_a 5.630171
_cell_length_b 11.515526
_cell_length_c 16.534408
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... | data_image0
_chemical_formula_structural Ca8Ta8Bi8O40
_chemical_formula_sum "Ca8 Ta8 Bi8 O40"
_cell_length_a 5.630171
_cell_length_b 11.515526
_cell_length_c 16.534408
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RotateAroundAtomAction | e19eafaf-9d48-448f-8c8a-e97a7a341550 | mp-1218449 | Rotate all surrounding atoms within 3.448 angstrom of the center atom at index 7 by 118.496 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Sr2Ca6Ir2O12
_chemical_formula_sum "Sr2 Ca6 Ir2 O12"
_cell_length_a 6.682358
_cell_length_b 6.682358
_cell_length_c 6.72167424
_cell_angle_alpha 89.13156517
_cell_angle_beta 89.13156517
_cell_angle_gamma 91.72627208
_space_group_na... | data_image0
_chemical_formula_structural Sr2Ca6Ir2O12
_chemical_formula_sum "Sr2 Ca6 Ir2 O12"
_cell_length_a 6.682358
_cell_length_b 6.682358
_cell_length_c 6.72167424
_cell_angle_alpha 89.13156517
_cell_angle_beta 89.13156517
_cell_angle_gamma 91.72627208
_space_group_na... |
RotateAroundAtomAction | 29a4cc7e-d06c-4496-936d-0cb6a59560d0 | mp-2219699 | Rotate all surrounding atoms within 2.006 angstrom of the center atom at index 3 by 51.496 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K2MgRe2O8
_chemical_formula_sum "K2 Mg1 Re2 O8"
_cell_length_a 5.54549561
_cell_length_b 6.37898571
_cell_length_c 7.9827836
_cell_angle_alpha 113.78128377
_cell_angle_beta 110.25819822000001
_cell_angle_gamma 90.07065235
_space_gr... | data_image0
_chemical_formula_structural K2MgRe2O8
_chemical_formula_sum "K2 Mg1 Re2 O8"
_cell_length_a 5.54549561
_cell_length_b 6.37898571
_cell_length_c 7.9827836
_cell_angle_alpha 113.78128377
_cell_angle_beta 110.25819822000001
_cell_angle_gamma 90.07065235
_space_gr... |
RotateAroundAtomAction | fa43bb53-8352-465e-a078-144a119e7721 | mp-777965 | Rotate all surrounding atoms within 3.274 angstrom of the center atom at index 20 by 80.875 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na4Ti11O24
_chemical_formula_sum "Na4 Ti11 O24"
_cell_length_a 10.50339217
_cell_length_b 10.50339217
_cell_length_c 6.15520938
_cell_angle_alpha 73.95641705
_cell_angle_beta 73.95641705
_cell_angle_gamma 119.97407326000001
_space_... | data_image0
_chemical_formula_structural Na4Ti11O24
_chemical_formula_sum "Na4 Ti11 O24"
_cell_length_a 10.50339217
_cell_length_b 10.50339217
_cell_length_c 6.15520938
_cell_angle_alpha 73.95641705
_cell_angle_beta 73.95641705
_cell_angle_gamma 119.97407326000001
_space_... |
RotateAroundAtomAction | adeda4cf-d9a6-4750-a321-e7cc56f903e7 | mp-1218473 | Rotate all surrounding atoms within 2.926 angstrom of the center atom at index 7 by 214.942 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Sr3CaCu2O6
_chemical_formula_sum "Sr3 Ca1 Cu2 O6"
_cell_length_a 6.80543418
_cell_length_b 6.80543418
_cell_length_c 6.96655439
_cell_angle_alpha 75.182527
_cell_angle_beta 75.182527
_cell_angle_gamma 33.62898998999999
_space_group... | data_image0
_chemical_formula_structural Sr3CaCu2O6
_chemical_formula_sum "Sr3 Ca1 Cu2 O6"
_cell_length_a 6.80543418
_cell_length_b 6.80543418
_cell_length_c 6.96655439
_cell_angle_alpha 75.182527
_cell_angle_beta 75.182527
_cell_angle_gamma 33.62898998999999
_space_group... |
RotateAroundAtomAction | 540c3a48-01d3-4807-b05f-c1ef27fc1c2a | mp-2230615 | Rotate all surrounding atoms within 3.649 angstrom of the center atom at index 18 by 170.53 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural MgCo5SnO12
_chemical_formula_sum "Mg1 Co5 Sn1 O12"
_cell_length_a 5.16798225
_cell_length_b 5.06228585
_cell_length_c 10.05426768
_cell_angle_alpha 93.92568172
_cell_angle_beta 97.56611219000001
_cell_angle_gamma 59.34081011
_space... | data_image0
_chemical_formula_structural MgCo5SnO12
_chemical_formula_sum "Mg1 Co5 Sn1 O12"
_cell_length_a 5.16798225
_cell_length_b 5.06228585
_cell_length_c 10.05426768
_cell_angle_alpha 93.92568172
_cell_angle_beta 97.56611219000001
_cell_angle_gamma 59.34081011
_space... |
RotateAroundAtomAction | 94f6fa7b-22b7-4850-832a-deede53f7497 | mp-1209541 | Rotate all surrounding atoms within 2.421 angstrom of the center atom at index 8 by 258.847 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Se3N3O12
_chemical_formula_sum "Se3 N3 O12"
_cell_length_a 9.26032011
_cell_length_b 9.26032011
_cell_length_c 5.68882602
_cell_angle_alpha 82.87290882000002
_cell_angle_beta 82.87290882000002
_cell_angle_gamma 53.16993631
_space_g... | data_image0
_chemical_formula_structural Se3N3O12
_chemical_formula_sum "Se3 N3 O12"
_cell_length_a 9.26032011
_cell_length_b 9.26032011
_cell_length_c 5.68882602
_cell_angle_alpha 82.87290882000002
_cell_angle_beta 82.87290882000002
_cell_angle_gamma 53.16993631
_space_g... |
RotateAroundAtomAction | 54b5123d-befb-4806-84da-165df7b15b44 | mp-1209106 | Rotate all surrounding atoms within 2.506 angstrom of the center atom at index 19 by 211.865 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Sb8Cl2O12
_chemical_formula_sum "Sb8 Cl2 O12"
_cell_length_a 9.8282001
_cell_length_b 9.8282001
_cell_length_c 10.9813657
_cell_angle_alpha 69.18075124000002
_cell_angle_beta 69.18075124000002
_cell_angle_gamma 24.235533709999995
_... | data_image0
_chemical_formula_structural Sb8Cl2O12
_chemical_formula_sum "Sb8 Cl2 O12"
_cell_length_a 9.8282001
_cell_length_b 9.8282001
_cell_length_c 10.9813657
_cell_angle_alpha 69.18075124000002
_cell_angle_beta 69.18075124000002
_cell_angle_gamma 24.235533709999995
_... |
RotateAroundAtomAction | 1d168e98-b711-42e0-89ea-d7e093674507 | mp-1518830 | Rotate all surrounding atoms within 3.385 angstrom of the center atom at index 0 by 187.274 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K4Ba4Tb4Bi4O24
_chemical_formula_sum "K4 Ba4 Tb4 Bi4 O24"
_cell_length_a 8.74178874
_cell_length_b 8.70938544
_cell_length_c 8.75197493
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural K4Ba4Tb4Bi4O24
_chemical_formula_sum "K4 Ba4 Tb4 Bi4 O24"
_cell_length_a 8.74178874
_cell_length_b 8.70938544
_cell_length_c 8.75197493
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RotateAroundAtomAction | e962053b-3509-4c05-be66-ced434b76aca | mp-1047828 | Rotate all surrounding atoms within 3.391 angstrom of the center atom at index 22 by 80.468 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Mg2Mn8O18
_chemical_formula_sum "Mg2 Mn8 O18"
_cell_length_a 8.490018
_cell_length_b 8.490018
_cell_length_c 4.787582
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... | data_image0
_chemical_formula_structural Mg2Mn8O18
_chemical_formula_sum "Mg2 Mn8 O18"
_cell_length_a 8.490018
_cell_length_b 8.490018
_cell_length_c 4.787582
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_gro... |
RotateAroundAtomAction | 7d81615a-b9e5-4b4b-b751-671cc4f4d92d | mp-1205734 | Rotate all surrounding atoms within 3.718 angstrom of the center atom at index 6 by 110.724 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Y2Re4Si2C2
_chemical_formula_sum "Y2 Re4 Si2 C2"
_cell_length_a 5.80737617
_cell_length_b 5.807376170000001
_cell_length_c 7.317291
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 140.13848847999995
_space_group_name... | data_image0
_chemical_formula_structural Y2Re4Si2C2
_chemical_formula_sum "Y2 Re4 Si2 C2"
_cell_length_a 5.80737617
_cell_length_b 5.807376170000001
_cell_length_c 7.317291
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 140.13848847999995
_space_group_name... |
RotateAroundAtomAction | 4eb267e0-b1e4-444d-8282-599332305b2c | mp-559790 | Rotate all surrounding atoms within 3.499 angstrom of the center atom at index 0 by 181.073 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K4Nb6Cl14O10
_chemical_formula_sum "K4 Nb6 Cl14 O10"
_cell_length_a 9.65668465
_cell_length_b 9.65668465
_cell_length_c 11.31733892
_cell_angle_alpha 69.91254741
_cell_angle_beta 69.91254741
_cell_angle_gamma 55.54566693999999
_spa... | data_image0
_chemical_formula_structural K4Nb6Cl14O10
_chemical_formula_sum "K4 Nb6 Cl14 O10"
_cell_length_a 9.65668465
_cell_length_b 9.65668465
_cell_length_c 11.31733892
_cell_angle_alpha 69.91254741
_cell_angle_beta 69.91254741
_cell_angle_gamma 55.54566693999999
_spa... |
RotateAroundAtomAction | 0b9014cd-f9d1-4b45-98d6-fcd2b624f56a | mp-2209216 | Rotate all surrounding atoms within 3.932 angstrom of the center atom at index 8 by 228.314 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li16Zn4Ge6
_chemical_formula_sum "Li16 Zn4 Ge6"
_cell_length_a 9.14862888
_cell_length_b 9.14862888
_cell_length_c 9.14862899
_cell_angle_alpha 48.211775040000006
_cell_angle_beta 48.211775040000006
_cell_angle_gamma 48.21177448
_s... | data_image0
_chemical_formula_structural Li16Zn4Ge6
_chemical_formula_sum "Li16 Zn4 Ge6"
_cell_length_a 9.14862888
_cell_length_b 9.14862888
_cell_length_c 9.14862899
_cell_angle_alpha 48.211775040000006
_cell_angle_beta 48.211775040000006
_cell_angle_gamma 48.21177448
_s... |
RotateAroundAtomAction | 75d44790-3b07-4788-8364-fb5e3a517097 | mp-1221055 | Rotate all surrounding atoms within 2.939 angstrom of the center atom at index 40 by 207.326 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural NaMg2Al6VSi6B3H3O31
_chemical_formula_sum "Na1 Mg2 Al6 V1 Si6 B3 H3 O31"
_cell_length_a 9.6145201
_cell_length_b 9.6145201
_cell_length_c 7.22996037
_cell_angle_alpha 75.4273574
_cell_angle_beta 75.4273574
_cell_angle_gamma 113.8554... | data_image0
_chemical_formula_structural NaMg2Al6VSi6B3H3O31
_chemical_formula_sum "Na1 Mg2 Al6 V1 Si6 B3 H3 O31"
_cell_length_a 9.6145201
_cell_length_b 9.6145201
_cell_length_c 7.22996037
_cell_angle_alpha 75.4273574
_cell_angle_beta 75.4273574
_cell_angle_gamma 113.8554... |
RotateAroundAtomAction | 0b23e48d-8df3-4c81-b12a-ec7f933c446f | mp-850962 | Rotate all surrounding atoms within 3.85 angstrom of the center atom at index 41 by 133.412 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li6Fe12Si12O48
_chemical_formula_sum "Li6 Fe12 Si12 O48"
_cell_length_a 10.90735927
_cell_length_b 10.90735927
_cell_length_c 11.848258
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999553999999
_space_group_... | data_image0
_chemical_formula_structural Li6Fe12Si12O48
_chemical_formula_sum "Li6 Fe12 Si12 O48"
_cell_length_a 10.90735927
_cell_length_b 10.90735927
_cell_length_c 11.848258
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999553999999
_space_group_... |
RotateAroundAtomAction | 7261a965-1242-41f0-9b08-c011a21ac8a0 | mp-1202398 | Rotate all surrounding atoms within 2.718 angstrom of the center atom at index 34 by 160.126 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ge4C16N4Cl12
_chemical_formula_sum "Ge4 C16 N4 Cl12"
_cell_length_a 8.123458
_cell_length_b 8.500134
_cell_length_c 12.085114
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_s... | data_image0
_chemical_formula_structural Ge4C16N4Cl12
_chemical_formula_sum "Ge4 C16 N4 Cl12"
_cell_length_a 8.123458
_cell_length_b 8.500134
_cell_length_c 12.085114
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_s... |
RotateAroundAtomAction | 23bbfb56-034c-4950-b776-60cb5c17d075 | mp-1246294 | Rotate all surrounding atoms within 3.604 angstrom of the center atom at index 8 by 293.711 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Dy2Mg2Ti2S8
_chemical_formula_sum "Dy2 Mg2 Ti2 S8"
_cell_length_a 7.75151795
_cell_length_b 7.607206660000001
_cell_length_c 7.60030167
_cell_angle_alpha 58.66867511000001
_cell_angle_beta 59.36751187
_cell_angle_gamma 59.34563601
... | data_image0
_chemical_formula_structural Dy2Mg2Ti2S8
_chemical_formula_sum "Dy2 Mg2 Ti2 S8"
_cell_length_a 7.75151795
_cell_length_b 7.607206660000001
_cell_length_c 7.60030167
_cell_angle_alpha 58.66867511000001
_cell_angle_beta 59.36751187
_cell_angle_gamma 59.34563601
... |
RotateAroundAtomAction | 52b8e2ce-65d6-475b-aec2-532d4dd7f724 | mp-554002 | Rotate all surrounding atoms within 1.382 angstrom of the center atom at index 11 by 216.835 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Al2H6O6
_chemical_formula_sum "Al2 H6 O6"
_cell_length_a 4.959562
_cell_length_b 5.14807988
_cell_length_c 5.19558482
_cell_angle_alpha 103.44678532
_cell_angle_beta 98.72321195
_cell_angle_gamma 118.00210368
_space_group_name_H-M_... | data_image0
_chemical_formula_structural Al2H6O6
_chemical_formula_sum "Al2 H6 O6"
_cell_length_a 4.959562
_cell_length_b 5.14807988
_cell_length_c 5.19558482
_cell_angle_alpha 103.44678532
_cell_angle_beta 98.72321195
_cell_angle_gamma 118.00210368
_space_group_name_H-M_... |
RotateAroundAtomAction | 275227f7-e4f0-45e9-b892-79b5d34fa076 | mp-765804 | Rotate all surrounding atoms within 3.741 angstrom of the center atom at index 10 by 201.28 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li6VF8
_chemical_formula_sum "Li6 V1 F8"
_cell_length_a 5.93882439
_cell_length_b 5.93882439
_cell_length_c 5.93882439
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
_spac... | data_image0
_chemical_formula_structural Li6VF8
_chemical_formula_sum "Li6 V1 F8"
_cell_length_a 5.93882439
_cell_length_b 5.93882439
_cell_length_c 5.93882439
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
_spac... |
RotateAroundAtomAction | 9ac24934-c2c0-421d-b370-66d719aa2799 | mp-1250606 | Rotate all surrounding atoms within 3.22 angstrom of the center atom at index 30 by 254.928 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ca4Al2H20Cl2O16
_chemical_formula_sum "Ca4 Al2 H20 Cl2 O16"
_cell_length_a 10.74289779
_cell_length_b 8.85810288
_cell_length_c 8.85810288
_cell_angle_alpha 41.84762657000001
_cell_angle_beta 100.38471685999998
_cell_angle_gamma 100... | data_image0
_chemical_formula_structural Ca4Al2H20Cl2O16
_chemical_formula_sum "Ca4 Al2 H20 Cl2 O16"
_cell_length_a 10.74289779
_cell_length_b 8.85810288
_cell_length_c 8.85810288
_cell_angle_alpha 41.84762657000001
_cell_angle_beta 100.38471685999998
_cell_angle_gamma 100... |
RotateAroundAtomAction | 4bcda16e-2ba9-4aac-883c-0376d3fd13b7 | mp-2216235 | Rotate all surrounding atoms within 3.789 angstrom of the center atom at index 33 by 266.804 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural MgBi4P8O28
_chemical_formula_sum "Mg1 Bi4 P8 O28"
_cell_length_a 9.23606738
_cell_length_b 5.248148989999999
_cell_length_c 13.60261934
_cell_angle_alpha 89.69533841
_cell_angle_beta 103.8476226
_cell_angle_gamma 90.14299218999999
... | data_image0
_chemical_formula_structural MgBi4P8O28
_chemical_formula_sum "Mg1 Bi4 P8 O28"
_cell_length_a 9.23606738
_cell_length_b 5.248148989999999
_cell_length_c 13.60261934
_cell_angle_alpha 89.69533841
_cell_angle_beta 103.8476226
_cell_angle_gamma 90.14299218999999
... |
RotateAroundAtomAction | 674bffa7-6849-45b3-a42b-d97b45b59cf2 | mp-554749 | Rotate all surrounding atoms within 2.671 angstrom of the center atom at index 29 by 60.762 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural P18Ir6O54
_chemical_formula_sum "P18 Ir6 O54"
_cell_length_a 9.33263976
_cell_length_b 10.51496354
_cell_length_c 11.6246022
_cell_angle_alpha 113.40638887
_cell_angle_beta 109.84187317
_cell_angle_gamma 97.87824592
_space_group_na... | data_image0
_chemical_formula_structural P18Ir6O54
_chemical_formula_sum "P18 Ir6 O54"
_cell_length_a 9.33263976
_cell_length_b 10.51496354
_cell_length_c 11.6246022
_cell_angle_alpha 113.40638887
_cell_angle_beta 109.84187317
_cell_angle_gamma 97.87824592
_space_group_na... |
RotateAroundAtomAction | 3f17014f-5195-45c5-8f6a-f7cfd10ced68 | mp-1040209 | Rotate all surrounding atoms within 3.477 angstrom of the center atom at index 24 by 82.812 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural KMg30GaO32
_chemical_formula_sum "K1 Mg30 Ga1 O32"
_cell_length_a 8.606815
_cell_length_b 8.606815
_cell_length_c 8.552012
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... | data_image0
_chemical_formula_structural KMg30GaO32
_chemical_formula_sum "K1 Mg30 Ga1 O32"
_cell_length_a 8.606815
_cell_length_b 8.606815
_cell_length_c 8.552012
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... |
RotateAroundAtomAction | 950cae9f-9ff8-403d-bc23-b0dc7238549a | mp-19408 | Rotate all surrounding atoms within 3.338 angstrom of the center atom at index 24 by 61.33 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Li4V8O20
_chemical_formula_sum "Li4 V8 O20"
_cell_length_a 3.642142
_cell_length_b 9.89108
_cell_length_c 11.118627
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_group... | data_image0
_chemical_formula_structural Li4V8O20
_chemical_formula_sum "Li4 V8 O20"
_cell_length_a 3.642142
_cell_length_b 9.89108
_cell_length_c 11.118627
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_group... |
RotateAroundAtomAction | d08f2d9c-7553-459f-9d8c-16a9a7855920 | mp-9750 | Rotate all surrounding atoms within 2.645 angstrom of the center atom at index 9 by 95.841 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Sb2P2O10
_chemical_formula_sum "Sb2 P2 O10"
_cell_length_a 5.26815699
_cell_length_b 5.268157899999999
_cell_length_c 7.05433983
_cell_angle_alpha 106.36092716
_cell_angle_beta 106.36092178999999
_cell_angle_gamma 99.94077481000001
... | data_image0
_chemical_formula_structural Sb2P2O10
_chemical_formula_sum "Sb2 P2 O10"
_cell_length_a 5.26815699
_cell_length_b 5.268157899999999
_cell_length_c 7.05433983
_cell_angle_alpha 106.36092716
_cell_angle_beta 106.36092178999999
_cell_angle_gamma 99.94077481000001
... |
RotateAroundAtomAction | e45ba47b-fc94-489e-aa33-c0bb669e8f8b | mp-1028096 | Rotate all surrounding atoms within 3.262 angstrom of the center atom at index 15 by 164.862 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Mg14MnSi
_chemical_formula_sum "Mg14 Mn1 Si1"
_cell_length_a 6.20733672
_cell_length_b 6.20733624
_cell_length_c 10.20989807
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000254
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Mg14MnSi
_chemical_formula_sum "Mg14 Mn1 Si1"
_cell_length_a 6.20733672
_cell_length_b 6.20733624
_cell_length_c 10.20989807
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000254
_space_group_name_H-M_alt "... |
RotateAroundAtomAction | bc6da1a5-c433-4ab4-a8ed-9d6b05047414 | mp-680113 | Rotate all surrounding atoms within 3.968 angstrom of the center atom at index 32 by 295.435 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Cd11I22
_chemical_formula_sum "Cd11 I22"
_cell_length_a 4.34388855
_cell_length_b 4.34388855
_cell_length_c 81.037434
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000844999998
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Cd11I22
_chemical_formula_sum "Cd11 I22"
_cell_length_a 4.34388855
_cell_length_b 4.34388855
_cell_length_c 81.037434
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000844999998
_space_group_name_H-M_alt "P... |
RotateAroundAtomAction | 57267765-d93f-40ea-bb7b-cb2396fc2b2c | mp-729907 | Rotate all surrounding atoms within 1.997 angstrom of the center atom at index 54 by 116.493 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural NiH48C16S8N2O14
_chemical_formula_sum "Ni1 H48 C16 S8 N2 O14"
_cell_length_a 9.869812
_cell_length_b 10.48013754
_cell_length_c 11.416248020000001
_cell_angle_alpha 116.00684819999996
_cell_angle_beta 109.69344817
_cell_angle_gamma ... | data_image0
_chemical_formula_structural NiH48C16S8N2O14
_chemical_formula_sum "Ni1 H48 C16 S8 N2 O14"
_cell_length_a 9.869812
_cell_length_b 10.48013754
_cell_length_c 11.416248020000001
_cell_angle_alpha 116.00684819999996
_cell_angle_beta 109.69344817
_cell_angle_gamma ... |
RotateAroundAtomAction | 2df2171f-64ef-4bed-b449-87dfd95e8df9 | mp-622785 | Rotate all surrounding atoms within 2.812 angstrom of the center atom at index 16 by 97.404 degree around the axis [ 0. 0. -1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Fe16S16N16O16
_chemical_formula_sum "Fe16 S16 N16 O16"
_cell_length_a 10.435039
_cell_length_b 11.217004
_cell_length_c 15.292553349999999
_cell_angle_alpha 58.19865374999999
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_grou... | data_image0
_chemical_formula_structural Fe16S16N16O16
_chemical_formula_sum "Fe16 S16 N16 O16"
_cell_length_a 10.435039
_cell_length_b 11.217004
_cell_length_c 15.292553349999999
_cell_angle_alpha 58.19865374999999
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_grou... |
RotateAroundAtomAction | 0c87e41f-d5c0-4167-b486-317fd5aca8dc | mp-1207874 | Rotate all surrounding atoms within 3.508 angstrom of the center atom at index 24 by 183.959 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Y6Si7Ni16
_chemical_formula_sum "Y6 Si7 Ni16"
_cell_length_a 8.3055221
_cell_length_b 8.3055221
_cell_length_c 8.3055221
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
_sp... | data_image0
_chemical_formula_structural Y6Si7Ni16
_chemical_formula_sum "Y6 Si7 Ni16"
_cell_length_a 8.3055221
_cell_length_b 8.3055221
_cell_length_c 8.3055221
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
_sp... |
RotateAroundAtomAction | 0b443986-8750-45a7-a1b9-e09a4a7ba405 | mp-11609 | Rotate all surrounding atoms within 2.622 angstrom of the center atom at index 3 by 128.286 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Sb2Mo4S4
_chemical_formula_sum "Sb2 Mo4 S4"
_cell_length_a 3.20347563
_cell_length_b 6.55778366
_cell_length_c 9.48259106
_cell_angle_alpha 105.60859122
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Sb2Mo4S4
_chemical_formula_sum "Sb2 Mo4 S4"
_cell_length_a 3.20347563
_cell_length_b 6.55778366
_cell_length_c 9.48259106
_cell_angle_alpha 105.60859122
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... |
RotateAroundAtomAction | 1282a085-dec5-47ee-873c-920b6fcee634 | mp-861612 | Rotate all surrounding atoms within 2.863 angstrom of the center atom at index 18 by 63.153 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Cr2Fe2P4O16
_chemical_formula_sum "Cr2 Fe2 P4 O16"
_cell_length_a 5.848363
_cell_length_b 4.837312
_cell_length_c 9.9654035
_cell_angle_alpha 88.98505063
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural Cr2Fe2P4O16
_chemical_formula_sum "Cr2 Fe2 P4 O16"
_cell_length_a 5.848363
_cell_length_b 4.837312
_cell_length_c 9.9654035
_cell_angle_alpha 88.98505063
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
RotateAroundAtomAction | ebb7818b-cd37-4759-afd3-db88bbfbeaf4 | mp-661715 | Rotate all surrounding atoms within 3.946 angstrom of the center atom at index 4 by 153.497 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ti2S2Cl12O2
_chemical_formula_sum "Ti2 S2 Cl12 O2"
_cell_length_a 6.632096
_cell_length_b 8.1887806
_cell_length_c 11.22515027
_cell_angle_alpha 108.50382951
_cell_angle_beta 91.38155874
_cell_angle_gamma 113.71642866
_space_group_... | data_image0
_chemical_formula_structural Ti2S2Cl12O2
_chemical_formula_sum "Ti2 S2 Cl12 O2"
_cell_length_a 6.632096
_cell_length_b 8.1887806
_cell_length_c 11.22515027
_cell_angle_alpha 108.50382951
_cell_angle_beta 91.38155874
_cell_angle_gamma 113.71642866
_space_group_... |
RotateAroundAtomAction | 65fd92ef-f65a-4f6f-8ee0-6b1f1f8461ec | mp-28730 | Rotate all surrounding atoms within 3.288 angstrom of the center atom at index 59 by 99.691 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural In28Cl36
_chemical_formula_sum "In28 Cl36"
_cell_length_a 12.2317628
_cell_length_b 12.2317628
_cell_length_c 12.2317628
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... | data_image0
_chemical_formula_structural In28Cl36
_chemical_formula_sum "In28 Cl36"
_cell_length_a 12.2317628
_cell_length_b 12.2317628
_cell_length_c 12.2317628
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RotateAroundAtomAction | ded8e321-f19a-4ff4-a5a0-9975623aca56 | mp-1245687 | Rotate all surrounding atoms within 3.923 angstrom of the center atom at index 22 by 150.292 degree around the axis [1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ta16Te12N8
_chemical_formula_sum "Ta16 Te12 N8"
_cell_length_a 5.530197
_cell_length_b 10.747467
_cell_length_c 15.00584
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... | data_image0
_chemical_formula_structural Ta16Te12N8
_chemical_formula_sum "Ta16 Te12 N8"
_cell_length_a 5.530197
_cell_length_b 10.747467
_cell_length_c 15.00584
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RotateAroundAtomAction | eb10e7bd-42f8-4010-a8b5-7650a4c75aa5 | mp-1033461 | Rotate all surrounding atoms within 2.438 angstrom of the center atom at index 2 by 146.518 degree around the axis [ 0. -1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural BaMg6CrO8
_chemical_formula_sum "Ba1 Mg6 Cr1 O8"
_cell_length_a 8.75022402
_cell_length_b 4.70931995
_cell_length_c 4.70931995
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... | data_image0
_chemical_formula_structural BaMg6CrO8
_chemical_formula_sum "Ba1 Mg6 Cr1 O8"
_cell_length_a 8.75022402
_cell_length_b 4.70931995
_cell_length_c 4.70931995
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RotateAroundAtomAction | 680a8c4a-9f57-4217-9d25-121c58472864 | mp-1223543 | Rotate all surrounding atoms within 3.038 angstrom of the center atom at index 38 by 123.764 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural K4H12Se8O24
_chemical_formula_sum "K4 H12 Se8 O24"
_cell_length_a 6.438519
_cell_length_b 6.476977
_cell_length_c 16.205754
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... | data_image0
_chemical_formula_structural K4H12Se8O24
_chemical_formula_sum "K4 H12 Se8 O24"
_cell_length_a 6.438519
_cell_length_b 6.476977
_cell_length_c 16.205754
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RotateAroundAtomAction | 5aaa53b7-fc38-4668-95a1-b5ca87ee12f0 | mp-1176381 | Rotate all surrounding atoms within 3.151 angstrom of the center atom at index 22 by 207.218 degree around the axis [0. 1. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Na4Li2Fe2P2C2O14
_chemical_formula_sum "Na4 Li2 Fe2 P2 C2 O14"
_cell_length_a 5.160677
_cell_length_b 6.65493372
_cell_length_c 8.860766310000002
_cell_angle_alpha 89.02148639
_cell_angle_beta 87.9522642
_cell_angle_gamma 89.8605170... | data_image0
_chemical_formula_structural Na4Li2Fe2P2C2O14
_chemical_formula_sum "Na4 Li2 Fe2 P2 C2 O14"
_cell_length_a 5.160677
_cell_length_b 6.65493372
_cell_length_c 8.860766310000002
_cell_angle_alpha 89.02148639
_cell_angle_beta 87.9522642
_cell_angle_gamma 89.8605170... |
RotateAroundAtomAction | 6616da5b-a1e3-4c8d-843d-02145a74a091 | mp-1206399 | Rotate all surrounding atoms within 3.876 angstrom of the center atom at index 4 by 92.987 degree around the axis [-1. 0. 0.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Rb2LiVCl6
_chemical_formula_sum "Rb2 Li1 V1 Cl6"
_cell_length_a 7.12508199
_cell_length_b 7.125081989999999
_cell_length_c 6.076225
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999987000001
_space_group_name... | data_image0
_chemical_formula_structural Rb2LiVCl6
_chemical_formula_sum "Rb2 Li1 V1 Cl6"
_cell_length_a 7.12508199
_cell_length_b 7.125081989999999
_cell_length_c 6.076225
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999987000001
_space_group_name... |
RotateAroundAtomAction | 4faf1d9a-70e7-4d00-beaf-093c97d12ecf | mp-1219666 | Rotate all surrounding atoms within 3.933 angstrom of the center atom at index 9 by 130.488 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Rb3Se2O8
_chemical_formula_sum "Rb3 Se2 O8"
_cell_length_a 6.15841454
_cell_length_b 6.15841454
_cell_length_c 8.52826787
_cell_angle_alpha 67.49247653
_cell_angle_beta 67.49247652999999
_cell_angle_gamma 60.11680434000001
_space_g... | data_image0
_chemical_formula_structural Rb3Se2O8
_chemical_formula_sum "Rb3 Se2 O8"
_cell_length_a 6.15841454
_cell_length_b 6.15841454
_cell_length_c 8.52826787
_cell_angle_alpha 67.49247653
_cell_angle_beta 67.49247652999999
_cell_angle_gamma 60.11680434000001
_space_g... |
RotateAroundAtomAction | 62915227-fa04-4736-8cee-432b1e52f6b8 | mp-1190028 | Rotate all surrounding atoms within 3.399 angstrom of the center atom at index 1 by 310.439 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Tm3Al9Ni6
_chemical_formula_sum "Tm3 Al9 Ni6"
_cell_length_a 8.89713641
_cell_length_b 8.89713641
_cell_length_c 4.02623636
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000286999999
_space_group_name_H-M_alt... | data_image0
_chemical_formula_structural Tm3Al9Ni6
_chemical_formula_sum "Tm3 Al9 Ni6"
_cell_length_a 8.89713641
_cell_length_b 8.89713641
_cell_length_c 4.02623636
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000286999999
_space_group_name_H-M_alt... |
RotateAroundAtomAction | 1c69af55-1034-4a97-b290-10e9a5c7cb45 | mp-1042880 | Rotate all surrounding atoms within 3.257 angstrom of the center atom at index 10 by 177.468 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Zn4Ni6O16
_chemical_formula_sum "Zn4 Ni6 O16"
_cell_length_a 5.75358048
_cell_length_b 5.75358048
_cell_length_c 9.188489
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000555
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Zn4Ni6O16
_chemical_formula_sum "Zn4 Ni6 O16"
_cell_length_a 5.75358048
_cell_length_b 5.75358048
_cell_length_c 9.188489
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000555
_space_group_name_H-M_alt "P 1... |
RotateAroundAtomAction | 4bc2174c-8058-4acc-aed6-df4b648efbb6 | mp-1217245 | Rotate all surrounding atoms within 2.238 angstrom of the center atom at index 0 by 286.219 degree around the axis [0. 0. 1.] in the cif file. The rotation should following the right-hand rule. | data_image0
_chemical_formula_structural Ti3FeBi5O15
_chemical_formula_sum "Ti3 Fe1 Bi5 O15"
_cell_length_a 3.9680035
_cell_length_b 3.9680035
_cell_length_c 20.70600862
_cell_angle_alpha 84.57108651
_cell_angle_beta 84.57108651
_cell_angle_gamma 88.55952303
_space_group_... | data_image0
_chemical_formula_structural Ti3FeBi5O15
_chemical_formula_sum "Ti3 Fe1 Bi5 O15"
_cell_length_a 3.9680035
_cell_length_b 3.9680035
_cell_length_c 20.70600862
_cell_angle_alpha 84.57108651
_cell_angle_beta 84.57108651
_cell_angle_gamma 88.55952303
_space_group_... |
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