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 |
|---|---|---|---|---|---|
RemoveAtomAction | 2ab3a613-2430-4f40-b043-ab84c2964d24 | mp-1224477 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural H11IN2O6
_chemical_formula_sum "H11 I1 N2 O6"
_cell_length_a 5.540447
_cell_length_b 5.54602506
_cell_length_c 5.55388201
_cell_angle_alpha 77.76500148
_cell_angle_beta 77.61327356
_cell_angle_gamma 77.87890795
_space_group_name_H-... | data_image0
_chemical_formula_structural H11INO6
_chemical_formula_sum "H11 I1 N1 O6"
_cell_length_a 5.540447
_cell_length_b 5.54602506
_cell_length_c 5.55388201
_cell_angle_alpha 77.76500148
_cell_angle_beta 77.61327356
_cell_angle_gamma 77.87890795
_space_group_name_H-M... |
RemoveAtomAction | e796007c-99bc-4ed2-9cba-ef75d3225e9b | mp-2230319 | Remove the atom at index 14 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgFe6O6F6
_chemical_formula_sum "Mg1 Fe6 O6 F6"
_cell_length_a 5.04393797
_cell_length_b 14.3697501
_cell_length_c 3.088218
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 88.21357987
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural MgFe6O6F5
_chemical_formula_sum "Mg1 Fe6 O6 F5"
_cell_length_a 5.04393797
_cell_length_b 14.3697501
_cell_length_c 3.088218
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 88.21357987
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | ab2c4a50-4741-4c97-b530-5f4fc05cfed1 | mp-1198979 | Remove the atom at index 29 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K6Na14MgTl18
_chemical_formula_sum "K6 Na14 Mg1 Tl18"
_cell_length_a 10.60143563
_cell_length_b 10.60143563
_cell_length_c 10.60143563
_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 K6Na14MgTl17
_chemical_formula_sum "K6 Na14 Mg1 Tl17"
_cell_length_a 10.60143563
_cell_length_b 10.60143563
_cell_length_c 10.60143563
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 70b0a1f6-7c85-4396-9d99-6385315a36ad | mp-557992 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural In4Te4Cl4O12
_chemical_formula_sum "In4 Te4 Cl4 O12"
_cell_length_a 7.031733
_cell_length_b 7.196003
_cell_length_c 8.64328525
_cell_angle_alpha 77.23700394
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural In4Te3Cl4O12
_chemical_formula_sum "In4 Te3 Cl4 O12"
_cell_length_a 7.031733
_cell_length_b 7.196003
_cell_length_c 8.64328525
_cell_angle_alpha 77.23700394
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 1eb2fe8d-a677-4309-a18d-be4aaf74642c | mp-758446 | Remove the atom at index 28 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4V8C8O32
_chemical_formula_sum "Li4 V8 C8 O32"
_cell_length_a 9.469308
_cell_length_b 6.287829
_cell_length_c 11.24251521
_cell_angle_alpha 56.8776801
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Li4V8C8O31
_chemical_formula_sum "Li4 V8 C8 O31"
_cell_length_a 9.469308
_cell_length_b 6.287829
_cell_length_c 11.24251521
_cell_angle_alpha 56.8776801
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... |
RemoveAtomAction | d6aa2ea9-1ef8-41ba-b406-87802a6c9165 | mp-1236280 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural LiCd4Tc4O12
_chemical_formula_sum "Li1 Cd4 Tc4 O12"
_cell_length_a 5.52414711
_cell_length_b 5.608893130000001
_cell_length_c 7.94369997
_cell_angle_alpha 91.11645933999999
_cell_angle_beta 87.9547835
_cell_angle_gamma 89.9784879199... | data_image0
_chemical_formula_structural LiCd4Tc4O11
_chemical_formula_sum "Li1 Cd4 Tc4 O11"
_cell_length_a 5.52414711
_cell_length_b 5.608893130000001
_cell_length_c 7.94369997
_cell_angle_alpha 91.11645933999999
_cell_angle_beta 87.9547835
_cell_angle_gamma 89.9784879199... |
RemoveAtomAction | dfef182a-98ea-4a99-9cd9-d9cd226cca2f | mp-1040917 | Remove the atom at index 26 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca4Fe8P8O32
_chemical_formula_sum "Ca4 Fe8 P8 O32"
_cell_length_a 9.10227172
_cell_length_b 9.10227172
_cell_length_c 16.95686224
_cell_angle_alpha 63.17755244
_cell_angle_beta 63.17755244
_cell_angle_gamma 32.23924191999999
_space... | data_image0
_chemical_formula_structural Ca4Fe8P8O31
_chemical_formula_sum "Ca4 Fe8 P8 O31"
_cell_length_a 9.10227172
_cell_length_b 9.10227172
_cell_length_c 16.95686224
_cell_angle_alpha 63.17755244
_cell_angle_beta 63.17755244
_cell_angle_gamma 32.23924191999999
_space... |
RemoveAtomAction | 37d87292-e433-468a-8e54-39f1bf261c31 | mp-1180897 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K2PdN2Cl2O4
_chemical_formula_sum "K2 Pd1 N2 Cl2 O4"
_cell_length_a 4.732359
_cell_length_b 7.05971384
_cell_length_c 7.877666200000001
_cell_angle_alpha 67.3422171
_cell_angle_beta 75.08665789
_cell_angle_gamma 81.19090223
_space_... | data_image0
_chemical_formula_structural K2PdN2Cl2O3
_chemical_formula_sum "K2 Pd1 N2 Cl2 O3"
_cell_length_a 4.732359
_cell_length_b 7.05971384
_cell_length_c 7.877666200000001
_cell_angle_alpha 67.3422171
_cell_angle_beta 75.08665789
_cell_angle_gamma 81.19090223
_space_... |
RemoveAtomAction | 3e04e992-0e0d-4d6b-bb7f-ec9b457e904a | mp-1290409 | Remove the atom at index 15 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Mn6Sb2O16
_chemical_formula_sum "Li8 Mn6 Sb2 O16"
_cell_length_a 6.09914414
_cell_length_b 6.09721732
_cell_length_c 10.77720194
_cell_angle_alpha 90.38703345
_cell_angle_beta 72.8532928
_cell_angle_gamma 62.07008206999999
_spac... | data_image0
_chemical_formula_structural Li8Mn6SbO16
_chemical_formula_sum "Li8 Mn6 Sb1 O16"
_cell_length_a 6.09914414
_cell_length_b 6.09721732
_cell_length_c 10.77720194
_cell_angle_alpha 90.38703345
_cell_angle_beta 72.8532928
_cell_angle_gamma 62.07008206999999
_space... |
RemoveAtomAction | ae287870-402f-4272-b011-0c16c05625a0 | mp-1208402 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural U2Pb2I12
_chemical_formula_sum "U2 Pb2 I12"
_cell_length_a 7.62870236
_cell_length_b 7.646974490000001
_cell_length_c 14.14774958
_cell_angle_alpha 90.02645336999998
_cell_angle_beta 89.93478277000001
_cell_angle_gamma 119.888295969... | data_image0
_chemical_formula_structural U2Pb2I11
_chemical_formula_sum "U2 Pb2 I11"
_cell_length_a 7.62870236
_cell_length_b 7.646974490000001
_cell_length_c 14.14774958
_cell_angle_alpha 90.02645336999998
_cell_angle_beta 89.93478277000001
_cell_angle_gamma 119.888295969... |
RemoveAtomAction | 59a54177-2140-4f77-ad59-370c0d1d2c98 | mp-636946 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Fe12Ge10
_chemical_formula_sum "Fe12 Ge10"
_cell_length_a 6.30166754
_cell_length_b 6.30166754
_cell_length_c 7.797893349999999
_cell_angle_alpha 74.68624363
_cell_angle_beta 74.68624363
_cell_angle_gamma 76.65132412
_space_group_n... | data_image0
_chemical_formula_structural Fe11Ge10
_chemical_formula_sum "Fe11 Ge10"
_cell_length_a 6.30166754
_cell_length_b 6.30166754
_cell_length_c 7.797893349999999
_cell_angle_alpha 74.68624363
_cell_angle_beta 74.68624363
_cell_angle_gamma 76.65132412
_space_group_n... |
RemoveAtomAction | 5e1dadf7-c176-479f-8d11-03e522ba67ba | mp-1188515 | Remove the atom at index 18 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca4In2Os2O12
_chemical_formula_sum "Ca4 In2 Os2 O12"
_cell_length_a 5.543428
_cell_length_b 5.75755
_cell_length_c 9.64876458
_cell_angle_alpha 90.0
_cell_angle_beta 124.4938725
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Ca4In2Os2O11
_chemical_formula_sum "Ca4 In2 Os2 O11"
_cell_length_a 5.543428
_cell_length_b 5.75755
_cell_length_c 9.64876458
_cell_angle_alpha 90.0
_cell_angle_beta 124.4938725
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... |
RemoveAtomAction | 5161ce45-0c31-4da4-8db0-55739f0ac08d | mp-1232328 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cu3Sb4O6F6
_chemical_formula_sum "Cu3 Sb4 O6 F6"
_cell_length_a 7.0716257
_cell_length_b 7.0716257
_cell_length_c 7.0716257
_cell_angle_alpha 109.47122063
_cell_angle_beta 109.47122063
_cell_angle_gamma 109.47122063
_space_group_na... | data_image0
_chemical_formula_structural Cu3Sb3O6F6
_chemical_formula_sum "Cu3 Sb3 O6 F6"
_cell_length_a 7.0716257
_cell_length_b 7.0716257
_cell_length_c 7.0716257
_cell_angle_alpha 109.47122063
_cell_angle_beta 109.47122063
_cell_angle_gamma 109.47122063
_space_group_na... |
RemoveAtomAction | d4a86a2d-5fda-4b5e-ab5d-ab721b6c4771 | mp-1225817 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Dy2Fe4Co4B2
_chemical_formula_sum "Dy2 Fe4 Co4 B2"
_cell_length_a 5.06930308
_cell_length_b 5.04179819
_cell_length_c 6.84308372
_cell_angle_alpha 89.99078127
_cell_angle_beta 90.04833519999998
_cell_angle_gamma 119.85780878999999
... | data_image0
_chemical_formula_structural Dy2Fe4Co4B
_chemical_formula_sum "Dy2 Fe4 Co4 B1"
_cell_length_a 5.06930308
_cell_length_b 5.04179819
_cell_length_c 6.84308372
_cell_angle_alpha 89.99078127
_cell_angle_beta 90.04833519999998
_cell_angle_gamma 119.85780878999999
_... |
RemoveAtomAction | 346279a8-4ce2-4775-ba49-ec692525dc80 | mp-4647 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K3Cu8Se6
_chemical_formula_sum "K3 Cu8 Se6"
_cell_length_a 9.22750883
_cell_length_b 9.22750883
_cell_length_c 10.12313235
_cell_angle_alpha 75.13046743
_cell_angle_beta 75.13046743
_cell_angle_gamma 24.949460250000026
_space_group... | data_image0
_chemical_formula_structural K3Cu7Se6
_chemical_formula_sum "K3 Cu7 Se6"
_cell_length_a 9.22750883
_cell_length_b 9.22750883
_cell_length_c 10.12313235
_cell_angle_alpha 75.13046743
_cell_angle_beta 75.13046743
_cell_angle_gamma 24.949460250000026
_space_group... |
RemoveAtomAction | 6c10be81-6cc8-4353-9b11-8bcb125da639 | mp-1026788 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural LaMg14Ga
_chemical_formula_sum "La1 Mg14 Ga1"
_cell_length_a 6.54181914
_cell_length_b 6.54181858
_cell_length_c 10.3752619
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000281
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural LaMg13Ga
_chemical_formula_sum "La1 Mg13 Ga1"
_cell_length_a 6.54181914
_cell_length_b 6.54181858
_cell_length_c 10.3752619
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000281
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 2c0c6796-32a0-4324-b19d-74bfb94dc701 | mp-1106174 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Tb14Rh6
_chemical_formula_sum "Tb14 Rh6"
_cell_length_a 6.19766051
_cell_length_b 9.79902498
_cell_length_c 9.798996650000001
_cell_angle_alpha 120.00022491999995
_cell_angle_beta 90.00107083000002
_cell_angle_gamma 90.00095888
_sp... | data_image0
_chemical_formula_structural Tb13Rh6
_chemical_formula_sum "Tb13 Rh6"
_cell_length_a 6.19766051
_cell_length_b 9.79902498
_cell_length_c 9.798996650000001
_cell_angle_alpha 120.00022491999995
_cell_angle_beta 90.00107083000002
_cell_angle_gamma 90.00095888
_sp... |
RemoveAtomAction | d0d6f722-bb25-4a9b-98ad-678b91891423 | mp-666156 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na4Te8O18
_chemical_formula_sum "Na4 Te8 O18"
_cell_length_a 7.007354
_cell_length_b 7.49488785
_cell_length_c 10.77485356
_cell_angle_alpha 109.56126807
_cell_angle_beta 91.05942188000002
_cell_angle_gamma 109.51584756
_space_grou... | data_image0
_chemical_formula_structural Na3Te8O18
_chemical_formula_sum "Na3 Te8 O18"
_cell_length_a 7.007354
_cell_length_b 7.49488785
_cell_length_c 10.77485356
_cell_angle_alpha 109.56126807
_cell_angle_beta 91.05942188000002
_cell_angle_gamma 109.51584756
_space_grou... |
RemoveAtomAction | 30b17824-9320-44ad-b85e-232ec5cab84a | mp-1220577 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nd3GdZr4O14
_chemical_formula_sum "Nd3 Gd1 Zr4 O14"
_cell_length_a 7.53064465
_cell_length_b 7.53064465
_cell_length_c 7.53064416
_cell_angle_alpha 59.75301876
_cell_angle_beta 59.75301876
_cell_angle_gamma 59.7530154
_space_group_... | data_image0
_chemical_formula_structural Nd3GdZr4O13
_chemical_formula_sum "Nd3 Gd1 Zr4 O13"
_cell_length_a 7.53064465
_cell_length_b 7.53064465
_cell_length_c 7.53064416
_cell_angle_alpha 59.75301876
_cell_angle_beta 59.75301876
_cell_angle_gamma 59.7530154
_space_group_... |
RemoveAtomAction | 8e577611-d45d-4652-86ca-948264bc485e | mp-1102378 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nd4Re8
_chemical_formula_sum "Nd4 Re8"
_cell_length_a 5.50780632
_cell_length_b 5.50780632
_cell_length_c 8.90484191
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001918
_space_group_name_H-M_alt "P 1"
_sp... | data_image0
_chemical_formula_structural Nd4Re7
_chemical_formula_sum "Nd4 Re7"
_cell_length_a 5.50780632
_cell_length_b 5.50780632
_cell_length_c 8.90484191
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001918
_space_group_name_H-M_alt "P 1"
_sp... |
RemoveAtomAction | 084a7a7f-2e6b-4971-8e7e-cd7a0229d07c | mp-1214455 | Remove the atom at index 28 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba4Fe8Si8O28
_chemical_formula_sum "Ba4 Fe8 Si8 O28"
_cell_length_a 14.016061
_cell_length_b 7.209923
_cell_length_c 7.607207749999999
_cell_angle_alpha 61.73702037999999
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_na... | data_image0
_chemical_formula_structural Ba4Fe8Si8O27
_chemical_formula_sum "Ba4 Fe8 Si8 O27"
_cell_length_a 14.016061
_cell_length_b 7.209923
_cell_length_c 7.607207749999999
_cell_angle_alpha 61.73702037999999
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_na... |
RemoveAtomAction | d1863dfb-a1e9-4271-be11-6802f7f2e3e4 | mp-1245786 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural In12Ga8N16
_chemical_formula_sum "In12 Ga8 N16"
_cell_length_a 6.338033
_cell_length_b 10.699933
_cell_length_c 8.523877
_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 In12Ga8N15
_chemical_formula_sum "In12 Ga8 N15"
_cell_length_a 6.338033
_cell_length_b 10.699933
_cell_length_c 8.523877
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RemoveAtomAction | 48d62242-dd6d-47d1-984d-5bddf253c373 | mp-772276 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cr4P4O20
_chemical_formula_sum "Cr4 P4 O20"
_cell_length_a 5.180952
_cell_length_b 8.38677856
_cell_length_c 9.309508530000002
_cell_angle_alpha 102.25086210999999
_cell_angle_beta 104.36657557999999
_cell_angle_gamma 91.41059046
_... | data_image0
_chemical_formula_structural Cr4P3O20
_chemical_formula_sum "Cr4 P3 O20"
_cell_length_a 5.180952
_cell_length_b 8.38677856
_cell_length_c 9.309508530000002
_cell_angle_alpha 102.25086210999999
_cell_angle_beta 104.36657557999999
_cell_angle_gamma 91.41059046
_... |
RemoveAtomAction | c89f8a84-f79b-47ea-9c59-bd032a8b84d9 | mp-1214285 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Be8Si8Ag16O32
_chemical_formula_sum "Be8 Si8 Ag16 O32"
_cell_length_a 5.043717
_cell_length_b 10.149675
_cell_length_c 14.40424
_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 Be7Si8Ag16O32
_chemical_formula_sum "Be7 Si8 Ag16 O32"
_cell_length_a 5.043717
_cell_length_b 10.149675
_cell_length_c 14.40424
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... |
RemoveAtomAction | 904ffff2-df6c-42da-9580-0f1734239f22 | mp-615141 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Pb2Cl4O8
_chemical_formula_sum "Pb2 Cl4 O8"
_cell_length_a 7.15446275
_cell_length_b 7.1544627499999995
_cell_length_c 6.113388
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 129.35804315
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Pb2Cl4O7
_chemical_formula_sum "Pb2 Cl4 O7"
_cell_length_a 7.15446275
_cell_length_b 7.1544627499999995
_cell_length_c 6.113388
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 129.35804315
_space_group_name_H-M_alt ... |
RemoveAtomAction | 38cd8554-4ff0-4683-930a-f82ced44105c | mp-1346690 | Remove the atom at index 14 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg2Sn2P4O14
_chemical_formula_sum "Mg2 Sn2 P4 O14"
_cell_length_a 6.72597
_cell_length_b 7.04770682
_cell_length_c 7.12831135
_cell_angle_alpha 75.45766706
_cell_angle_beta 63.34739348
_cell_angle_gamma 80.09216731
_space_group_nam... | data_image0
_chemical_formula_structural Mg2Sn2P4O13
_chemical_formula_sum "Mg2 Sn2 P4 O13"
_cell_length_a 6.72597
_cell_length_b 7.04770682
_cell_length_c 7.12831135
_cell_angle_alpha 75.45766706
_cell_angle_beta 63.34739348
_cell_angle_gamma 80.09216731
_space_group_nam... |
RemoveAtomAction | 2c870d0f-4927-4706-9d69-f7fa05cb623e | mp-755554 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li2Fe2F8
_chemical_formula_sum "Li2 Fe2 F8"
_cell_length_a 4.58985747
_cell_length_b 5.536503
_cell_length_c 4.94910913
_cell_angle_alpha 90.0
_cell_angle_beta 90.89908099999998
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Li2Fe2F7
_chemical_formula_sum "Li2 Fe2 F7"
_cell_length_a 4.58985747
_cell_length_b 5.536503
_cell_length_c 4.94910913
_cell_angle_alpha 90.0
_cell_angle_beta 90.89908099999998
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... |
RemoveAtomAction | 69720442-4d1b-4bd9-bed0-9205b7675120 | mp-555706 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Al4Si4H8O20
_chemical_formula_sum "Li4 Al4 Si4 H8 O20"
_cell_length_a 4.796556
_cell_length_b 9.028016
_cell_length_c 11.744496
_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 Li4Al4Si3H8O20
_chemical_formula_sum "Li4 Al4 Si3 H8 O20"
_cell_length_a 4.796556
_cell_length_b 9.028016
_cell_length_c 11.744496
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | 509add5d-5643-47c1-b487-a548865a1339 | mp-1522321 | Remove the atom at index 16 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K4Sr4Ce4Sb4O24
_chemical_formula_sum "K4 Sr4 Ce4 Sb4 O24"
_cell_length_a 8.47630223
_cell_length_b 8.4464501
_cell_length_c 8.4381874
_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 K4Sr4Ce4Sb4O23
_chemical_formula_sum "K4 Sr4 Ce4 Sb4 O23"
_cell_length_a 8.47630223
_cell_length_b 8.4464501
_cell_length_c 8.4381874
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 9bfa6a39-f5e0-475e-8056-5591da346dc1 | mp-770944 | Remove the atom at index 27 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Co4C8S2O32
_chemical_formula_sum "Li8 Co4 C8 S2 O32"
_cell_length_a 9.145502
_cell_length_b 9.15633002
_cell_length_c 9.24263428
_cell_angle_alpha 118.92522838999999
_cell_angle_beta 118.89628031
_cell_angle_gamma 91.29093861
_s... | data_image0
_chemical_formula_structural Li8Co4C8S2O31
_chemical_formula_sum "Li8 Co4 C8 S2 O31"
_cell_length_a 9.145502
_cell_length_b 9.15633002
_cell_length_c 9.24263428
_cell_angle_alpha 118.92522838999999
_cell_angle_beta 118.89628031
_cell_angle_gamma 91.29093861
_s... |
RemoveAtomAction | 4905d4e0-4af8-4e15-970f-94c1f12fb309 | mp-1036398 | Remove the atom at index 28 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg14AlBO16
_chemical_formula_sum "Mg14 Al1 B1 O16"
_cell_length_a 8.43990036
_cell_length_b 8.43990036
_cell_length_c 4.18638648
_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 Mg14AlBO15
_chemical_formula_sum "Mg14 Al1 B1 O15"
_cell_length_a 8.43990036
_cell_length_b 8.43990036
_cell_length_c 4.18638648
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"... |
RemoveAtomAction | b49150da-4ccc-43a7-86b1-8f74d62b1f75 | mp-758607 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Co4Si4O16
_chemical_formula_sum "Li4 Co4 Si4 O16"
_cell_length_a 4.930845
_cell_length_b 6.860282
_cell_length_c 9.684071
_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 Li4Co4Si4O15
_chemical_formula_sum "Li4 Co4 Si4 O15"
_cell_length_a 4.930845
_cell_length_b 6.860282
_cell_length_c 9.684071
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... |
RemoveAtomAction | 31dae753-b7bf-434d-a107-ac20c0714de3 | mp-775316 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Ti4Fe12O32
_chemical_formula_sum "Li8 Ti4 Fe12 O32"
_cell_length_a 8.397925
_cell_length_b 8.40734447
_cell_length_c 8.612380319999998
_cell_angle_alpha 90.06248353
_cell_angle_beta 90.01226097
_cell_angle_gamma 90.14909803
_spa... | data_image0
_chemical_formula_structural Li8Ti3Fe12O32
_chemical_formula_sum "Li8 Ti3 Fe12 O32"
_cell_length_a 8.397925
_cell_length_b 8.40734447
_cell_length_c 8.612380319999998
_cell_angle_alpha 90.06248353
_cell_angle_beta 90.01226097
_cell_angle_gamma 90.14909803
_spa... |
RemoveAtomAction | 5d2d0799-fae7-4123-9810-610655f1a983 | mp-558350 | Remove the atom at index 27 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Zn16Te8Br16O24
_chemical_formula_sum "Zn16 Te8 Br16 O24"
_cell_length_a 7.830681
_cell_length_b 10.749647
_cell_length_c 16.485903
_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 Zn16Te8Br15O24
_chemical_formula_sum "Zn16 Te8 Br15 O24"
_cell_length_a 7.830681
_cell_length_b 10.749647
_cell_length_c 16.485903
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | b9a95827-9fa8-43be-82ab-f34c3c3902d8 | mp-2230319 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgFe6O6F6
_chemical_formula_sum "Mg1 Fe6 O6 F6"
_cell_length_a 5.04393797
_cell_length_b 14.3697501
_cell_length_c 3.088218
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 88.21357987
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural MgFe6O5F6
_chemical_formula_sum "Mg1 Fe6 O5 F6"
_cell_length_a 5.04393797
_cell_length_b 14.3697501
_cell_length_c 3.088218
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 88.21357987
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | 4c6a104c-fb63-4293-b21a-8bde91af3840 | mp-728512 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca8Ce4Ti2Si8B8O48
_chemical_formula_sum "Ca8 Ce4 Ti2 Si8 B8 O48"
_cell_length_a 4.8078
_cell_length_b 10.367604
_cell_length_c 19.06387455
_cell_angle_alpha 68.01810942
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name... | data_image0
_chemical_formula_structural Ca8Ce4TiSi8B8O48
_chemical_formula_sum "Ca8 Ce4 Ti1 Si8 B8 O48"
_cell_length_a 4.8078
_cell_length_b 10.367604
_cell_length_c 19.06387455
_cell_angle_alpha 68.01810942
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_... |
RemoveAtomAction | 9cc2c080-4940-410a-bb38-2dae647426db | mp-1105449 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sm2Tl2P4Se12
_chemical_formula_sum "Sm2 Tl2 P4 Se12"
_cell_length_a 7.755927
_cell_length_b 6.911998
_cell_length_c 10.35507989
_cell_angle_alpha 88.99944141999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... | data_image0
_chemical_formula_structural Sm2Tl2P4Se11
_chemical_formula_sum "Sm2 Tl2 P4 Se11"
_cell_length_a 7.755927
_cell_length_b 6.911998
_cell_length_c 10.35507989
_cell_angle_alpha 88.99944141999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... |
RemoveAtomAction | f2e118ed-983a-4745-a3f2-0db0dae9412c | mp-608551 | Remove the atom at index 16 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ti2Al4Br16
_chemical_formula_sum "Ti2 Al4 Br16"
_cell_length_a 6.402735
_cell_length_b 10.46939
_cell_length_c 13.512877
_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 Ti2Al4Br15
_chemical_formula_sum "Ti2 Al4 Br15"
_cell_length_a 6.402735
_cell_length_b 10.46939
_cell_length_c 13.512877
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RemoveAtomAction | ceb948db-3a44-45c8-91df-e4aed04409cb | mp-1176688 | Remove the atom at index 24 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li12Fe12Si12O48
_chemical_formula_sum "Li12 Fe12 Si12 O48"
_cell_length_a 5.485882
_cell_length_b 8.264865
_cell_length_c 18.762459
_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 Li12Fe12Si11O48
_chemical_formula_sum "Li12 Fe12 Si11 O48"
_cell_length_a 5.485882
_cell_length_b 8.264865
_cell_length_c 18.762459
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 28262885-5f6a-4734-8f2a-87ecb392e34e | mp-30447 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr18Cd8Bi18
_chemical_formula_sum "Sr18 Cd8 Bi18"
_cell_length_a 4.92851629
_cell_length_b 13.3750904
_cell_length_c 23.587212490000002
_cell_angle_alpha 89.99999363
_cell_angle_beta 90.00000449
_cell_angle_gamma 90.00000158
_space... | data_image0
_chemical_formula_structural Sr18Cd7Bi18
_chemical_formula_sum "Sr18 Cd7 Bi18"
_cell_length_a 4.92851629
_cell_length_b 13.3750904
_cell_length_c 23.587212490000002
_cell_angle_alpha 89.99999363
_cell_angle_beta 90.00000449
_cell_angle_gamma 90.00000158
_space... |
RemoveAtomAction | 9656f7bb-6334-41bc-900a-b74da715f909 | mp-9511 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K4As2Au2S8
_chemical_formula_sum "K4 As2 Au2 S8"
_cell_length_a 6.93280871
_cell_length_b 6.61767417
_cell_length_c 9.58799398
_cell_angle_alpha 87.05264167
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural K3As2Au2S8
_chemical_formula_sum "K3 As2 Au2 S8"
_cell_length_a 6.93280871
_cell_length_b 6.61767417
_cell_length_c 9.58799398
_cell_angle_alpha 87.05264167
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 4dd10a40-ec2b-4403-83c2-166909dc8667 | mp-1048483 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba2AlNi3O7
_chemical_formula_sum "Ba2 Al1 Ni3 O7"
_cell_length_a 3.750112
_cell_length_b 3.911509
_cell_length_c 11.334825
_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 Ba2AlNi3O6
_chemical_formula_sum "Ba2 Al1 Ni3 O6"
_cell_length_a 3.750112
_cell_length_b 3.911509
_cell_length_c 11.334825
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... |
RemoveAtomAction | 147095a9-7961-4c0b-b703-f3a5fcfb4a96 | mp-756803 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li3Fe4NiO8
_chemical_formula_sum "Li3 Fe4 Ni1 O8"
_cell_length_a 5.99879997
_cell_length_b 5.99879997
_cell_length_c 5.98749598
_cell_angle_alpha 60.26840743
_cell_angle_beta 60.26840743
_cell_angle_gamma 59.43487156
_space_group_n... | data_image0
_chemical_formula_structural Li3Fe3NiO8
_chemical_formula_sum "Li3 Fe3 Ni1 O8"
_cell_length_a 5.99879997
_cell_length_b 5.99879997
_cell_length_c 5.98749598
_cell_angle_alpha 60.26840743
_cell_angle_beta 60.26840743
_cell_angle_gamma 59.43487156
_space_group_n... |
RemoveAtomAction | 8db820b5-2f4e-45ca-a331-b7a26a453911 | mp-758878 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li3Fe8O3F13
_chemical_formula_sum "Li3 Fe8 O3 F13"
_cell_length_a 6.31150868
_cell_length_b 6.31150868
_cell_length_c 10.450769760000002
_cell_angle_alpha 72.02306054
_cell_angle_beta 72.02306054
_cell_angle_gamma 59.370140129999996... | data_image0
_chemical_formula_structural Li2Fe8O3F13
_chemical_formula_sum "Li2 Fe8 O3 F13"
_cell_length_a 6.31150868
_cell_length_b 6.31150868
_cell_length_c 10.450769760000002
_cell_angle_alpha 72.02306054
_cell_angle_beta 72.02306054
_cell_angle_gamma 59.370140129999996... |
RemoveAtomAction | e3a2468e-4454-4e82-9702-00fa8075d2cf | mp-1028212 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural LaMg14Al
_chemical_formula_sum "La1 Mg14 Al1"
_cell_length_a 6.5266893
_cell_length_b 6.52668874
_cell_length_c 10.36455099
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000283999998
_space_group_name_H-M_alt... | data_image0
_chemical_formula_structural LaMg13Al
_chemical_formula_sum "La1 Mg13 Al1"
_cell_length_a 6.5266893
_cell_length_b 6.52668874
_cell_length_c 10.36455099
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000283999998
_space_group_name_H-M_alt... |
RemoveAtomAction | f7012c2e-3284-4b5c-a30c-a05338eb1cd3 | mp-1205225 | Remove the atom at index 43 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Fe6P12O54
_chemical_formula_sum "Fe6 P12 O54"
_cell_length_a 9.26045587
_cell_length_b 9.26045587
_cell_length_c 17.125258
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999909000002
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Fe6P12O53
_chemical_formula_sum "Fe6 P12 O53"
_cell_length_a 9.26045587
_cell_length_b 9.26045587
_cell_length_c 17.125258
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999909000002
_space_group_name_H-M_alt ... |
RemoveAtomAction | efa7dbf8-a41d-43aa-a92a-073b71a85d58 | mp-1214002 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ce3P6Pd20
_chemical_formula_sum "Ce3 P6 Pd20"
_cell_length_a 8.69849863
_cell_length_b 8.69862915
_cell_length_c 8.69743528
_cell_angle_alpha 60.03301289000001
_cell_angle_beta 60.03334011999999
_cell_angle_gamma 60.03013740000001
... | data_image0
_chemical_formula_structural Ce3P5Pd20
_chemical_formula_sum "Ce3 P5 Pd20"
_cell_length_a 8.69849863
_cell_length_b 8.69862915
_cell_length_c 8.69743528
_cell_angle_alpha 60.03301289000001
_cell_angle_beta 60.03334011999999
_cell_angle_gamma 60.03013740000001
... |
RemoveAtomAction | 7f8b16a8-6c49-48b7-b634-936b0b67b9b7 | mp-1080028 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr2ZrTiO6
_chemical_formula_sum "Sr2 Zr1 Ti1 O6"
_cell_length_a 5.74935971
_cell_length_b 5.74935971
_cell_length_c 5.74935971
_cell_angle_alpha 120.33852864999999
_cell_angle_beta 120.33852864999999
_cell_angle_gamma 89.4146445
_s... | data_image0
_chemical_formula_structural Sr2ZrTiO5
_chemical_formula_sum "Sr2 Zr1 Ti1 O5"
_cell_length_a 5.74935971
_cell_length_b 5.74935971
_cell_length_c 5.74935971
_cell_angle_alpha 120.33852864999999
_cell_angle_beta 120.33852864999999
_cell_angle_gamma 89.4146445
_s... |
RemoveAtomAction | 20d379d5-863b-43c4-947f-766a3689e642 | mp-758001 | Remove the atom at index 22 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8V4C4O20
_chemical_formula_sum "Li8 V4 C4 O20"
_cell_length_a 2.939704
_cell_length_b 9.426139
_cell_length_c 12.017675
_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 Li8V4C4O19
_chemical_formula_sum "Li8 V4 C4 O19"
_cell_length_a 2.939704
_cell_length_b 9.426139
_cell_length_c 12.017675
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... |
RemoveAtomAction | 58efde8d-d763-47ca-b0a3-2cb00076597f | mp-1225690 | Remove the atom at index 15 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Er2Fe6Co6P7
_chemical_formula_sum "Er2 Fe6 Co6 P7"
_cell_length_a 3.607307
_cell_length_b 8.982424
_cell_length_c 8.98247072
_cell_angle_alpha 59.99830538
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Er2Fe6Co6P6
_chemical_formula_sum "Er2 Fe6 Co6 P6"
_cell_length_a 3.607307
_cell_length_b 8.982424
_cell_length_c 8.98247072
_cell_angle_alpha 59.99830538
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 068f10df-0973-405f-9e0a-d5349a440c91 | mp-978989 | Remove the atom at index 18 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Tc14B6
_chemical_formula_sum "Tc14 B6"
_cell_length_a 7.46654839
_cell_length_b 7.4665463800000005
_cell_length_c 4.82992795
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99981629
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Tc14B5
_chemical_formula_sum "Tc14 B5"
_cell_length_a 7.46654839
_cell_length_b 7.4665463800000005
_cell_length_c 4.82992795
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99981629
_space_group_name_H-M_alt "... |
RemoveAtomAction | 9b7b3031-4be9-4130-a0ee-01cc7f776263 | mp-568761 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ag16Te16
_chemical_formula_sum "Ag16 Te16"
_cell_length_a 4.78356307
_cell_length_b 8.96352613
_cell_length_c 20.0509739
_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 Ag15Te16
_chemical_formula_sum "Ag15 Te16"
_cell_length_a 4.78356307
_cell_length_b 8.96352613
_cell_length_c 20.0509739
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RemoveAtomAction | aaf575d7-1b87-4918-9a24-72932e580b04 | mp-17383 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ni8Ge4
_chemical_formula_sum "Ni8 Ge4"
_cell_length_a 3.78795382
_cell_length_b 5.09612578
_cell_length_c 7.17851986
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_grou... | data_image0
_chemical_formula_structural Ni7Ge4
_chemical_formula_sum "Ni7 Ge4"
_cell_length_a 3.78795382
_cell_length_b 5.09612578
_cell_length_c 7.17851986
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_grou... |
RemoveAtomAction | 40c5d4ec-d9e1-4dde-b8c7-903c4a620600 | mp-1199395 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Zr4O12F20
_chemical_formula_sum "Zr4 O12 F20"
_cell_length_a 16.97047429
_cell_length_b 16.53675226
_cell_length_c 6.08330734
_cell_angle_alpha 83.58662603000002
_cell_angle_beta 75.54508631
_cell_angle_gamma 20.868287659999996
_sp... | data_image0
_chemical_formula_structural Zr4O11F20
_chemical_formula_sum "Zr4 O11 F20"
_cell_length_a 16.97047429
_cell_length_b 16.53675226
_cell_length_c 6.08330734
_cell_angle_alpha 83.58662603000002
_cell_angle_beta 75.54508631
_cell_angle_gamma 20.868287659999996
_sp... |
RemoveAtomAction | 929ba214-b1db-4104-83c4-ab883e76ba3b | mp-1029422 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nb2Zn4N6
_chemical_formula_sum "Nb2 Zn4 N6"
_cell_length_a 5.69129974
_cell_length_b 5.76525118
_cell_length_c 5.38931929
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.43078747999999
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Nb2Zn3N6
_chemical_formula_sum "Nb2 Zn3 N6"
_cell_length_a 5.69129974
_cell_length_b 5.76525118
_cell_length_c 5.38931929
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.43078747999999
_space_group_name_H-M_alt ... |
RemoveAtomAction | 24b8cbfb-0bbd-4399-bef0-6ed5c3ecce87 | mp-1217800 | Remove the atom at index 14 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ta12MoO33
_chemical_formula_sum "Ta12 Mo1 O33"
_cell_length_a 11.45759689
_cell_length_b 11.45759689
_cell_length_c 17.96622001
_cell_angle_alpha 57.109881130000005
_cell_angle_beta 57.109881130000005
_cell_angle_gamma 19.3969724099... | data_image0
_chemical_formula_structural Ta12MoO32
_chemical_formula_sum "Ta12 Mo1 O32"
_cell_length_a 11.45759689
_cell_length_b 11.45759689
_cell_length_c 17.96622001
_cell_angle_alpha 57.109881130000005
_cell_angle_beta 57.109881130000005
_cell_angle_gamma 19.3969724099... |
RemoveAtomAction | 56f0be59-f779-43c0-bbb7-2e52545843d0 | mp-1214079 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca6Cd32Cu
_chemical_formula_sum "Ca6 Cd32 Cu1"
_cell_length_a 9.730385
_cell_length_b 9.730385
_cell_length_c 9.730385
_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 Ca5Cd32Cu
_chemical_formula_sum "Ca5 Cd32 Cu1"
_cell_length_a 9.730385
_cell_length_b 9.730385
_cell_length_c 9.730385
_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... |
RemoveAtomAction | 4416a488-aaa5-4e29-9be3-a5ecd7de19f2 | mp-28297 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nd12S8Br20
_chemical_formula_sum "Nd12 S8 Br20"
_cell_length_a 6.927289
_cell_length_b 7.256481
_cell_length_c 22.787283
_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 Nd11S8Br20
_chemical_formula_sum "Nd11 S8 Br20"
_cell_length_a 6.927289
_cell_length_b 7.256481
_cell_length_c 22.787283
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_... |
RemoveAtomAction | eba0376f-2f67-4513-9ec3-f1f2ec6d2d2f | mp-1218215 | Remove the atom at index 33 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ta8Cu3S24
_chemical_formula_sum "Ta8 Cu3 S24"
_cell_length_a 3.42696889
_cell_length_b 9.62368759
_cell_length_c 21.665108739999997
_cell_angle_alpha 89.49460957000001
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_... | data_image0
_chemical_formula_structural Ta8Cu3S23
_chemical_formula_sum "Ta8 Cu3 S23"
_cell_length_a 3.42696889
_cell_length_b 9.62368759
_cell_length_c 21.665108739999997
_cell_angle_alpha 89.49460957000001
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_... |
RemoveAtomAction | a5235e26-58e0-4a45-a2b7-1a9efec232d5 | mp-1224199 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ho12Co9
_chemical_formula_sum "Ho12 Co9"
_cell_length_a 4.04348636
_cell_length_b 11.13594434
_cell_length_c 11.13575248
_cell_angle_alpha 60.0033272
_cell_angle_beta 90.00003881
_cell_angle_gamma 90.00060509000001
_space_group_nam... | data_image0
_chemical_formula_structural Ho11Co9
_chemical_formula_sum "Ho11 Co9"
_cell_length_a 4.04348636
_cell_length_b 11.13594434
_cell_length_c 11.13575248
_cell_angle_alpha 60.0033272
_cell_angle_beta 90.00003881
_cell_angle_gamma 90.00060509000001
_space_group_nam... |
RemoveAtomAction | 23a7b1be-647d-4c0f-991b-b768d61975ce | mp-728431 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Cr4O18
_chemical_formula_sum "Li4 Cr4 O18"
_cell_length_a 8.53267349
_cell_length_b 8.53267349
_cell_length_c 6.6120849
_cell_angle_alpha 83.09252253
_cell_angle_beta 96.90747747
_cell_angle_gamma 120.35945653
_space_group_name_... | data_image0
_chemical_formula_structural Li4Cr4O17
_chemical_formula_sum "Li4 Cr4 O17"
_cell_length_a 8.53267349
_cell_length_b 8.53267349
_cell_length_c 6.6120849
_cell_angle_alpha 83.09252253
_cell_angle_beta 96.90747747
_cell_angle_gamma 120.35945653
_space_group_name_... |
RemoveAtomAction | a1715219-b5f1-45cc-9564-557c57e4700f | mp-559593 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural P3S9N15F6
_chemical_formula_sum "P3 S9 N15 F6"
_cell_length_a 11.52852389
_cell_length_b 11.52852389
_cell_length_c 11.528524
_cell_angle_alpha 117.55470366999998
_cell_angle_beta 117.55470366999998
_cell_angle_gamma 117.55470631999... | data_image0
_chemical_formula_structural P3S8N15F6
_chemical_formula_sum "P3 S8 N15 F6"
_cell_length_a 11.52852389
_cell_length_b 11.52852389
_cell_length_c 11.528524
_cell_angle_alpha 117.55470366999998
_cell_angle_beta 117.55470366999998
_cell_angle_gamma 117.55470631999... |
RemoveAtomAction | fe151133-6889-47a6-bee6-47b5a104608a | mp-1177360 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Mn3V3Fe2O16
_chemical_formula_sum "Li4 Mn3 V3 Fe2 O16"
_cell_length_a 5.91454
_cell_length_b 5.915028330000001
_cell_length_c 9.61285066
_cell_angle_alpha 89.11781684
_cell_angle_beta 88.27540368
_cell_angle_gamma 60.24362554
_s... | data_image0
_chemical_formula_structural Li3Mn3V3Fe2O16
_chemical_formula_sum "Li3 Mn3 V3 Fe2 O16"
_cell_length_a 5.91454
_cell_length_b 5.915028330000001
_cell_length_c 9.61285066
_cell_angle_alpha 89.11781684
_cell_angle_beta 88.27540368
_cell_angle_gamma 60.24362554
_s... |
RemoveAtomAction | edea8547-43d3-496c-aacf-40a21e66f6ed | mp-557500 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural LiNiP2S6
_chemical_formula_sum "Li1 Ni1 P2 S6"
_cell_length_a 5.89583925
_cell_length_b 5.89583925
_cell_length_c 6.96370041
_cell_angle_alpha 82.41561003
_cell_angle_beta 82.41561003
_cell_angle_gamma 120.34450382000001
_space_gro... | data_image0
_chemical_formula_structural NiP2S6
_chemical_formula_sum "Ni1 P2 S6"
_cell_length_a 5.89583925
_cell_length_b 5.89583925
_cell_length_c 6.96370041
_cell_angle_alpha 82.41561003
_cell_angle_beta 82.41561003
_cell_angle_gamma 120.34450382000001
_space_group_nam... |
RemoveAtomAction | 28504284-be85-43e0-893b-a8bedb2a48f0 | mp-19489 | Remove the atom at index 57 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sm4Co4B20O40
_chemical_formula_sum "Sm4 Co4 B20 O40"
_cell_length_a 7.654513
_cell_length_b 8.746298
_cell_length_c 9.469615910000002
_cell_angle_alpha 86.99432535
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... | data_image0
_chemical_formula_structural Sm4Co4B20O39
_chemical_formula_sum "Sm4 Co4 B20 O39"
_cell_length_a 7.654513
_cell_length_b 8.746298
_cell_length_c 9.469615910000002
_cell_angle_alpha 86.99432535
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... |
RemoveAtomAction | a3b9b844-f1d5-452a-beb3-92b3ff0eecc9 | mp-1176082 | Remove the atom at index 28 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li9Mn2Co5O16
_chemical_formula_sum "Li9 Mn2 Co5 O16"
_cell_length_a 4.99545
_cell_length_b 5.87316598
_cell_length_c 10.22400406
_cell_angle_alpha 89.65759952
_cell_angle_beta 98.18897752
_cell_angle_gamma 106.55621967000002
_space... | data_image0
_chemical_formula_structural Li9Mn2Co5O15
_chemical_formula_sum "Li9 Mn2 Co5 O15"
_cell_length_a 4.99545
_cell_length_b 5.87316598
_cell_length_c 10.22400406
_cell_angle_alpha 89.65759952
_cell_angle_beta 98.18897752
_cell_angle_gamma 106.55621967000002
_space... |
RemoveAtomAction | 1e6ae851-dad3-466e-a784-ebfc58d445a1 | mp-775339 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4V2Si12O30
_chemical_formula_sum "Li4 V2 Si12 O30"
_cell_length_a 9.75245569
_cell_length_b 9.75245569
_cell_length_c 9.752455690000001
_cell_angle_alpha 131.77905279000004
_cell_angle_beta 118.29041556999998
_cell_angle_gamma 81.... | data_image0
_chemical_formula_structural Li3V2Si12O30
_chemical_formula_sum "Li3 V2 Si12 O30"
_cell_length_a 9.75245569
_cell_length_b 9.75245569
_cell_length_c 9.752455690000001
_cell_angle_alpha 131.77905279000004
_cell_angle_beta 118.29041556999998
_cell_angle_gamma 81.... |
RemoveAtomAction | 5f580d10-4993-4a65-a339-c31d610e14c6 | mp-1112417 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K2TaAuF6
_chemical_formula_sum "K2 Ta1 Au1 F6"
_cell_length_a 7.20553407
_cell_length_b 7.20553407
_cell_length_c 7.20553407
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
... | data_image0
_chemical_formula_structural KTaAuF6
_chemical_formula_sum "K1 Ta1 Au1 F6"
_cell_length_a 7.20553407
_cell_length_b 7.20553407
_cell_length_c 7.20553407
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
... |
RemoveAtomAction | 6357a5ae-147f-430a-9298-58c17b8d38f8 | mp-25285 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mn4Ni2O12
_chemical_formula_sum "Mn4 Ni2 O12"
_cell_length_a 5.01128075
_cell_length_b 5.01128075
_cell_length_c 10.013213
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.047743
_space_group_name_H-M_alt "P 1"... | data_image0
_chemical_formula_structural Mn3Ni2O12
_chemical_formula_sum "Mn3 Ni2 O12"
_cell_length_a 5.01128075
_cell_length_b 5.01128075
_cell_length_c 10.013213
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.047743
_space_group_name_H-M_alt "P 1"... |
RemoveAtomAction | 32c86ec1-b21b-4d17-a672-99f3de5739c2 | mp-2227842 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgBi4O8
_chemical_formula_sum "Mg1 Bi4 O8"
_cell_length_a 5.62608818
_cell_length_b 7.93709688
_cell_length_c 7.528547720000001
_cell_angle_alpha 65.96628476
_cell_angle_beta 55.84103581000001
_cell_angle_gamma 52.855121849999996
_... | data_image0
_chemical_formula_structural MgBi4O7
_chemical_formula_sum "Mg1 Bi4 O7"
_cell_length_a 5.62608818
_cell_length_b 7.93709688
_cell_length_c 7.528547720000001
_cell_angle_alpha 65.96628476
_cell_angle_beta 55.84103581000001
_cell_angle_gamma 52.855121849999996
_... |
RemoveAtomAction | 52b0f6e7-9887-4437-8191-e050ef704c06 | mp-558636 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca2Al4O8
_chemical_formula_sum "Ca2 Al4 O8"
_cell_length_a 3.75689449
_cell_length_b 5.56036099
_cell_length_c 7.059453099999999
_cell_angle_alpha 78.76788928
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Ca2Al4O7
_chemical_formula_sum "Ca2 Al4 O7"
_cell_length_a 3.75689449
_cell_length_b 5.56036099
_cell_length_c 7.059453099999999
_cell_angle_alpha 78.76788928
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 2c5e5150-96e3-41c3-a7c7-614726aa4454 | mp-570684 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Zr4Os8
_chemical_formula_sum "Zr4 Os8"
_cell_length_a 5.2087459
_cell_length_b 5.20874741
_cell_length_c 8.58838303
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000971999998
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Zr4Os7
_chemical_formula_sum "Zr4 Os7"
_cell_length_a 5.2087459
_cell_length_b 5.20874741
_cell_length_c 8.58838303
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000971999998
_space_group_name_H-M_alt "P 1... |
RemoveAtomAction | 464ef302-ba44-4f98-9f75-2c295db19527 | mp-18245 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na4Co4P4O16
_chemical_formula_sum "Na4 Co4 P4 O16"
_cell_length_a 5.079759
_cell_length_b 6.870334
_cell_length_c 8.975021
_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 Na4Co4P4O15
_chemical_formula_sum "Na4 Co4 P4 O15"
_cell_length_a 5.079759
_cell_length_b 6.870334
_cell_length_c 8.975021
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spac... |
RemoveAtomAction | 053dbc0a-db85-4571-b0d3-a1ce03681de7 | mp-571569 | Remove the atom at index 16 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cd9I18
_chemical_formula_sum "Cd9 I18"
_cell_length_a 4.28636008
_cell_length_b 4.28635996
_cell_length_c 64.37281574
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000093000001
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Cd9I17
_chemical_formula_sum "Cd9 I17"
_cell_length_a 4.28636008
_cell_length_b 4.28635996
_cell_length_c 64.37281574
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000093000001
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 7224cb58-85ef-4695-bb8a-f4ff0db93c76 | mp-759145 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li12Co12Si12O48
_chemical_formula_sum "Li12 Co12 Si12 O48"
_cell_length_a 8.025713
_cell_length_b 8.653149
_cell_length_c 17.3381364
_cell_angle_alpha 60.657230430000006
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_nam... | data_image0
_chemical_formula_structural Li12Co11Si12O48
_chemical_formula_sum "Li12 Co11 Si12 O48"
_cell_length_a 8.025713
_cell_length_b 8.653149
_cell_length_c 17.3381364
_cell_angle_alpha 60.657230430000006
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_nam... |
RemoveAtomAction | 1a1237b1-85fb-4bdf-bfa8-31c023292f2b | mp-1224658 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ho4Fe34C2
_chemical_formula_sum "Ho4 Fe34 C2"
_cell_length_a 8.249865
_cell_length_b 8.5140411
_cell_length_c 8.53877109
_cell_angle_alpha 119.90410991000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Ho4Fe33C2
_chemical_formula_sum "Ho4 Fe33 C2"
_cell_length_a 8.249865
_cell_length_b 8.5140411
_cell_length_c 8.53877109
_cell_angle_alpha 119.90410991000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 01600639-9011-45bf-9429-88d2326ca98f | mp-1228355 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba8Sn2Ge4S16Br4
_chemical_formula_sum "Ba8 Sn2 Ge4 S16 Br4"
_cell_length_a 9.107169
_cell_length_b 9.29278
_cell_length_c 12.108653
_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 Ba7Sn2Ge4S16Br4
_chemical_formula_sum "Ba7 Sn2 Ge4 S16 Br4"
_cell_length_a 9.107169
_cell_length_b 9.29278
_cell_length_c 12.108653
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RemoveAtomAction | ea9d7c3d-7b7a-4706-b2e4-bd011863b6cf | mp-626573 | Remove the atom at index 31 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Fe16H16O32
_chemical_formula_sum "Fe16 H16 O32"
_cell_length_a 6.015304
_cell_length_b 11.314208370000001
_cell_length_c 12.29183503
_cell_angle_alpha 96.5951154
_cell_angle_beta 90.06491777
_cell_angle_gamma 90.25076776999998
_spa... | data_image0
_chemical_formula_structural Fe16H15O32
_chemical_formula_sum "Fe16 H15 O32"
_cell_length_a 6.015304
_cell_length_b 11.314208370000001
_cell_length_c 12.29183503
_cell_angle_alpha 96.5951154
_cell_angle_beta 90.06491777
_cell_angle_gamma 90.25076776999998
_spa... |
RemoveAtomAction | 9741a1b9-fd1d-449d-bfa1-d04f960c4355 | mp-1522695 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KCaTbNbO6
_chemical_formula_sum "K1 Ca1 Tb1 Nb1 O6"
_cell_length_a 5.9966415
_cell_length_b 5.996641499999999
_cell_length_c 5.996641499999999
_cell_angle_alpha 59.999999999999986
_cell_angle_beta 59.999999999999986
_cell_angle_gamma ... | data_image0
_chemical_formula_structural KCaTbNbO5
_chemical_formula_sum "K1 Ca1 Tb1 Nb1 O5"
_cell_length_a 5.9966415
_cell_length_b 5.996641499999999
_cell_length_c 5.996641499999999
_cell_angle_alpha 59.999999999999986
_cell_angle_beta 59.999999999999986
_cell_angle_gamma ... |
RemoveAtomAction | 734b6c7c-d072-4a19-8820-ea4bb60969fc | mp-1196766 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ce2Ni4N34O48
_chemical_formula_sum "Ce2 Ni4 N34 O48"
_cell_length_a 10.25773665
_cell_length_b 10.25773665
_cell_length_c 10.25773665
_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 Ce2Ni4N33O48
_chemical_formula_sum "Ce2 Ni4 N33 O48"
_cell_length_a 10.25773665
_cell_length_b 10.25773665
_cell_length_c 10.25773665
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 6ec27778-fa59-4a80-bd4f-bdf3bc6332ee | mp-1520482 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KEuFeSnO6
_chemical_formula_sum "K1 Eu1 Fe1 Sn1 O6"
_cell_length_a 5.67554949
_cell_length_b 5.67554949
_cell_length_c 5.67554949
_cell_angle_alpha 60.00000000000001
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.9999999999... | data_image0
_chemical_formula_structural KEuFeSnO5
_chemical_formula_sum "K1 Eu1 Fe1 Sn1 O5"
_cell_length_a 5.67554949
_cell_length_b 5.67554949
_cell_length_c 5.67554949
_cell_angle_alpha 60.00000000000001
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.9999999999... |
RemoveAtomAction | f8dee6a2-12f9-46a5-9b4a-84597bc76949 | mp-613620 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rh16O24
_chemical_formula_sum "Rh16 O24"
_cell_length_a 5.16383549
_cell_length_b 5.4518602
_cell_length_c 14.75820022
_cell_angle_alpha 89.99988639
_cell_angle_beta 90.00004483
_cell_angle_gamma 89.99997548
_space_group_name_H-M_a... | data_image0
_chemical_formula_structural Rh16O23
_chemical_formula_sum "Rh16 O23"
_cell_length_a 5.16383549
_cell_length_b 5.4518602
_cell_length_c 14.75820022
_cell_angle_alpha 89.99988639
_cell_angle_beta 90.00004483
_cell_angle_gamma 89.99997548
_space_group_name_H-M_a... |
RemoveAtomAction | 70dbc595-9034-4f85-89d7-e12462f4d520 | mp-1225428 | Remove the atom at index 16 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Dy4V2Fe2O12
_chemical_formula_sum "Dy4 V2 Fe2 O12"
_cell_length_a 5.682189
_cell_length_b 5.250896
_cell_length_c 9.19555886
_cell_angle_alpha 55.284866669999985
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural Dy4V2Fe2O11
_chemical_formula_sum "Dy4 V2 Fe2 O11"
_cell_length_a 5.682189
_cell_length_b 5.250896
_cell_length_c 9.19555886
_cell_angle_alpha 55.284866669999985
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_al... |
RemoveAtomAction | f1bf6641-8de0-4997-b784-9784b2cfcde1 | mp-1208988 | Remove the atom at index 15 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sm3Ni9Sn6
_chemical_formula_sum "Sm3 Ni9 Sn6"
_cell_length_a 4.102391
_cell_length_b 9.58246961
_cell_length_c 9.58246961
_cell_angle_alpha 119.9999973
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"... | data_image0
_chemical_formula_structural Sm3Ni9Sn5
_chemical_formula_sum "Sm3 Ni9 Sn5"
_cell_length_a 4.102391
_cell_length_b 9.58246961
_cell_length_c 9.58246961
_cell_angle_alpha 119.9999973
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"... |
RemoveAtomAction | 121271f2-0e0b-4104-92aa-242b3ac75455 | mp-530449 | Remove the atom at index 56 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca21As14O56
_chemical_formula_sum "Ca21 As14 O56"
_cell_length_a 14.25577019
_cell_length_b 14.255770190000002
_cell_length_c 14.255769929999998
_cell_angle_alpha 45.07982220000001
_cell_angle_beta 45.07982220000001
_cell_angle_gamma ... | data_image0
_chemical_formula_structural Ca21As14O55
_chemical_formula_sum "Ca21 As14 O55"
_cell_length_a 14.25577019
_cell_length_b 14.255770190000002
_cell_length_c 14.255769929999998
_cell_angle_alpha 45.07982220000001
_cell_angle_beta 45.07982220000001
_cell_angle_gamma ... |
RemoveAtomAction | bda551ed-af3e-4203-96c4-bdbbdafc4dd8 | mp-604304 | Remove the atom at index 30 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Hg2H32Br12N8
_chemical_formula_sum "Hg2 H32 Br12 N8"
_cell_length_a 9.123975
_cell_length_b 9.129847
_cell_length_c 9.482614
_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 Hg2H31Br12N8
_chemical_formula_sum "Hg2 H31 Br12 N8"
_cell_length_a 9.123975
_cell_length_b 9.129847
_cell_length_c 9.482614
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_sp... |
RemoveAtomAction | 43aa69f5-cc0b-4795-bd4a-735f04233498 | mp-1102486 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sm2P2O8
_chemical_formula_sum "Sm2 P2 O8"
_cell_length_a 5.83727174
_cell_length_b 5.83727174
_cell_length_c 5.83727174
_cell_angle_alpha 106.06663024999999
_cell_angle_beta 106.06663024999999
_cell_angle_gamma 116.51870327
_space_... | data_image0
_chemical_formula_structural SmP2O8
_chemical_formula_sum "Sm1 P2 O8"
_cell_length_a 5.83727174
_cell_length_b 5.83727174
_cell_length_c 5.83727174
_cell_angle_alpha 106.06663024999999
_cell_angle_beta 106.06663024999999
_cell_angle_gamma 116.51870327
_space_g... |
RemoveAtomAction | 091537eb-e424-4900-b0d7-d0092f2c8fca | mp-768947 | Remove the atom at index 28 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li10Zn3Ge4O16
_chemical_formula_sum "Li10 Zn3 Ge4 O16"
_cell_length_a 5.231285
_cell_length_b 6.39117044
_cell_length_c 10.99877016
_cell_angle_alpha 90.21476274
_cell_angle_beta 90.37445161
_cell_angle_gamma 90.42332329000001
_spa... | data_image0
_chemical_formula_structural Li10Zn3Ge4O15
_chemical_formula_sum "Li10 Zn3 Ge4 O15"
_cell_length_a 5.231285
_cell_length_b 6.39117044
_cell_length_c 10.99877016
_cell_angle_alpha 90.21476274
_cell_angle_beta 90.37445161
_cell_angle_gamma 90.42332329000001
_spa... |
RemoveAtomAction | 603923e8-b57c-4bfa-83fd-33e72f952905 | mp-1174188 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li6Mn2Co2O10
_chemical_formula_sum "Li6 Mn2 Co2 O10"
_cell_length_a 2.906382
_cell_length_b 7.770289890000001
_cell_length_c 8.28969021
_cell_angle_alpha 105.28852112000001
_cell_angle_beta 90.2531899
_cell_angle_gamma 98.5773225099... | data_image0
_chemical_formula_structural Li6MnCo2O10
_chemical_formula_sum "Li6 Mn1 Co2 O10"
_cell_length_a 2.906382
_cell_length_b 7.770289890000001
_cell_length_c 8.28969021
_cell_angle_alpha 105.28852112000001
_cell_angle_beta 90.2531899
_cell_angle_gamma 98.57732250999... |
RemoveAtomAction | e7e9148b-bff8-4860-bcf1-208bebec998e | mp-778104 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na8V8O20
_chemical_formula_sum "Na8 V8 O20"
_cell_length_a 5.347748
_cell_length_b 6.609739
_cell_length_c 17.007004
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_grou... | data_image0
_chemical_formula_structural Na7V8O20
_chemical_formula_sum "Na7 V8 O20"
_cell_length_a 5.347748
_cell_length_b 6.609739
_cell_length_c 17.007004
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space_grou... |
RemoveAtomAction | 37885cc1-cba6-4e64-9034-edcb02e66f7b | mp-726132 | Remove the atom at index 13 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ta2N4Cl10
_chemical_formula_sum "Ta2 N4 Cl10"
_cell_length_a 10.54070225
_cell_length_b 10.54070225
_cell_length_c 10.540702249999999
_cell_angle_alpha 140.02971360000004
_cell_angle_beta 140.02971360000004
_cell_angle_gamma 57.8081... | data_image0
_chemical_formula_structural Ta2N4Cl9
_chemical_formula_sum "Ta2 N4 Cl9"
_cell_length_a 10.54070225
_cell_length_b 10.54070225
_cell_length_c 10.540702249999999
_cell_angle_alpha 140.02971360000004
_cell_angle_beta 140.02971360000004
_cell_angle_gamma 57.808185... |
RemoveAtomAction | b3eb77a7-a66d-4522-af78-836a0da899e7 | mp-1214497 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba10P6O24F2
_chemical_formula_sum "Ba10 P6 O24 F2"
_cell_length_a 10.36526542
_cell_length_b 10.36526542
_cell_length_c 7.792644
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999628
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Ba10P5O24F2
_chemical_formula_sum "Ba10 P5 O24 F2"
_cell_length_a 10.36526542
_cell_length_b 10.36526542
_cell_length_c 7.792644
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999628
_space_group_name_H-M_alt ... |
RemoveAtomAction | d3f93ad5-4820-4c7d-9484-46ba9c35dd4f | mp-1520242 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural BaNaPrSeO6
_chemical_formula_sum "Ba1 Na1 Pr1 Se1 O6"
_cell_length_a 5.89468683
_cell_length_b 5.89468683
_cell_length_c 5.89468683
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999... | data_image0
_chemical_formula_structural BaNaPrSeO5
_chemical_formula_sum "Ba1 Na1 Pr1 Se1 O5"
_cell_length_a 5.89468683
_cell_length_b 5.89468683
_cell_length_c 5.89468683
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999... |
RemoveAtomAction | 426f94b9-2651-46d8-ba53-a53c156cf4ac | mp-2713621 | Remove the atom at index 47 from the cif file. The indices of atoms are started from 0. | 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 Na12Zr4Ti4Si8P4O47
_chemical_formula_sum "Na12 Zr4 Ti4 Si8 P4 O47"
_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.... |
RemoveAtomAction | 14a44c83-b8d6-4d04-b38c-08ea7e9ec02e | mp-1213326 | Remove the atom at index 47 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cs2Tm2Nb12Br36
_chemical_formula_sum "Cs2 Tm2 Nb12 Br36"
_cell_length_a 9.8943093
_cell_length_b 9.8943093
_cell_length_c 18.473738
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999529
_space_group_name_H-M_a... | data_image0
_chemical_formula_structural Cs2Tm2Nb12Br35
_chemical_formula_sum "Cs2 Tm2 Nb12 Br35"
_cell_length_a 9.8943093
_cell_length_b 9.8943093
_cell_length_c 18.473738
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999529
_space_group_name_H-M_a... |
RemoveAtomAction | ce3bac8b-b3b3-470a-9dcd-24bbf818b0fe | mp-1103985 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nd9Pt6
_chemical_formula_sum "Nd9 Pt6"
_cell_length_a 7.70172695
_cell_length_b 7.701915030000001
_cell_length_c 7.701846680000001
_cell_angle_alpha 71.39027492
_cell_angle_beta 71.38926960999999
_cell_angle_gamma 71.38940419999999
... | data_image0
_chemical_formula_structural Nd8Pt6
_chemical_formula_sum "Nd8 Pt6"
_cell_length_a 7.70172695
_cell_length_b 7.701915030000001
_cell_length_c 7.701846680000001
_cell_angle_alpha 71.39027492
_cell_angle_beta 71.38926960999999
_cell_angle_gamma 71.38940419999999
... |
RemoveAtomAction | 08d1ee45-655f-4da8-b675-502a5070565f | mp-2227842 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgBi4O8
_chemical_formula_sum "Mg1 Bi4 O8"
_cell_length_a 5.62608818
_cell_length_b 7.93709688
_cell_length_c 7.528547720000001
_cell_angle_alpha 65.96628476
_cell_angle_beta 55.84103581000001
_cell_angle_gamma 52.855121849999996
_... | data_image0
_chemical_formula_structural Bi4O8
_chemical_formula_sum "Bi4 O8"
_cell_length_a 5.62608818
_cell_length_b 7.93709688
_cell_length_c 7.528547720000001
_cell_angle_alpha 65.96628476
_cell_angle_beta 55.84103581000001
_cell_angle_gamma 52.855121849999996
_space_... |
RemoveAtomAction | 8c1042f9-d15f-496b-abbc-ec7c45a129fe | mp-1027965 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural YMg14Ga
_chemical_formula_sum "Y1 Mg14 Ga1"
_cell_length_a 6.4783171
_cell_length_b 6.2636730499999995
_cell_length_c 10.37809344
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 118.90990617
_space_group_name_H-M_alt... | data_image0
_chemical_formula_structural YMg13Ga
_chemical_formula_sum "Y1 Mg13 Ga1"
_cell_length_a 6.4783171
_cell_length_b 6.2636730499999995
_cell_length_c 10.37809344
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 118.90990617
_space_group_name_H-M_alt... |
RemoveAtomAction | 601a36e5-31ba-4a71-bc7e-945b0b92cd39 | mp-2958 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Dy2B4C4
_chemical_formula_sum "Dy2 B4 C4"
_cell_length_a 3.57203823
_cell_length_b 5.33014105
_cell_length_c 5.33014105
_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 Dy2B4C3
_chemical_formula_sum "Dy2 B4 C3"
_cell_length_a 3.57203823
_cell_length_b 5.33014105
_cell_length_c 5.33014105
_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... |
RemoveAtomAction | 37bf09e5-a9f7-420b-b289-8be138dd7f60 | mp-542012 | Remove the atom at index 36 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rb8Hf6S28
_chemical_formula_sum "Rb8 Hf6 S28"
_cell_length_a 11.68521516
_cell_length_b 11.685215160000002
_cell_length_c 13.619825350000001
_cell_angle_alpha 69.26119854000001
_cell_angle_beta 69.26119854000001
_cell_angle_gamma 41... | data_image0
_chemical_formula_structural Rb8Hf6S27
_chemical_formula_sum "Rb8 Hf6 S27"
_cell_length_a 11.68521516
_cell_length_b 11.685215160000002
_cell_length_c 13.619825350000001
_cell_angle_alpha 69.26119854000001
_cell_angle_beta 69.26119854000001
_cell_angle_gamma 41... |
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