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 |
|---|---|---|---|---|---|
DeleteAroundAtomAction | 10bbdc1d-4c7b-4a0a-8ba9-8afa704adb62 | mp-1233843 | Delete all atoms within 3.939 angstrom around the atom at index 2 in the cif file. | data_image0
_chemical_formula_structural MgCo6O2F10
_chemical_formula_sum "Mg1 Co6 O2 F10"
_cell_length_a 5.20676922
_cell_length_b 5.20369253
_cell_length_c 9.241906809999998
_cell_angle_alpha 89.57896289
_cell_angle_beta 90.10114559
_cell_angle_gamma 99.40809487
_space_... | data_image0
_chemical_formula_structural CoOF2
_chemical_formula_sum "Co1 O1 F2"
_cell_length_a 5.20676922
_cell_length_b 5.20369253
_cell_length_c 9.241906809999998
_cell_angle_alpha 89.57896289
_cell_angle_beta 90.10114559
_cell_angle_gamma 99.40809487
_space_group_name... |
DeleteAroundAtomAction | 2f81cf14-0872-4944-96b7-27767aeea69c | mp-1246916 | Delete all atoms within 3.671 angstrom around the atom at index 11 in the cif file. | data_image0
_chemical_formula_structural Mg2Ni10N8
_chemical_formula_sum "Mg2 Ni10 N8"
_cell_length_a 7.759587
_cell_length_b 6.009984
_cell_length_c 4.348536
_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 MgNiN4
_chemical_formula_sum "Mg1 Ni1 N4"
_cell_length_a 7.759587
_cell_length_b 6.009984
_cell_length_c 4.348536
_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_I... |
DeleteAroundAtomAction | b5eda4a3-d5b1-4af6-90cd-16de23348ed6 | mp-1043721 | Delete all atoms within 2.392 angstrom around the atom at index 8 in the cif file. | data_image0
_chemical_formula_structural Mg4Sn4Bi4O20
_chemical_formula_sum "Mg4 Sn4 Bi4 O20"
_cell_length_a 11.054845
_cell_length_b 5.442748
_cell_length_c 8.7199251
_cell_angle_alpha 68.83335382
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Mg4Sn4Bi3O14
_chemical_formula_sum "Mg4 Sn4 Bi3 O14"
_cell_length_a 11.054845
_cell_length_b 5.442748
_cell_length_c 8.7199251
_cell_angle_alpha 68.83335382
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | 61806664-13b5-4636-b06f-3825c4987d6c | mp-1026795 | Delete all atoms within 3.974 angstrom around the atom at index 12 in the cif file. | data_image0
_chemical_formula_structural LiMg14W
_chemical_formula_sum "Li1 Mg14 W1"
_cell_length_a 6.29929991
_cell_length_b 6.299299410000001
_cell_length_c 9.95323684
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000267
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Mg6
_chemical_formula_sum "Mg6"
_cell_length_a 6.29929991
_cell_length_b 6.299299410000001
_cell_length_c 9.95323684
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000267
_space_group_name_H-M_alt "P 1"
_sp... |
DeleteAroundAtomAction | 60c1b279-dc64-4133-bd4d-fed6b2a1d588 | mp-763051 | Delete all atoms within 3.328 angstrom around the atom at index 21 in the cif file. | data_image0
_chemical_formula_structural Li8V4O8F4
_chemical_formula_sum "Li8 V4 O8 F4"
_cell_length_a 5.13099459
_cell_length_b 5.93920482
_cell_length_c 7.86264398
_cell_angle_alpha 100.88303528999998
_cell_angle_beta 70.52889016
_cell_angle_gamma 90.00075203
_space_gro... | data_image0
_chemical_formula_structural Li2V4O2
_chemical_formula_sum "Li2 V4 O2"
_cell_length_a 5.13099459
_cell_length_b 5.93920482
_cell_length_c 7.86264398
_cell_angle_alpha 100.88303528999998
_cell_angle_beta 70.52889016
_cell_angle_gamma 90.00075203
_space_group_na... |
DeleteAroundAtomAction | 18b2c31c-22cb-441a-89b3-c1d826b09226 | mp-1227489 | Delete all atoms within 3.544 angstrom around the atom at index 63 in the cif file. | data_image0
_chemical_formula_structural Ca2Al24O38
_chemical_formula_sum "Ca2 Al24 O38"
_cell_length_a 5.61109181
_cell_length_b 5.61109181
_cell_length_c 22.067731
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999779999999
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural CaAl17O29
_chemical_formula_sum "Ca1 Al17 O29"
_cell_length_a 5.61109181
_cell_length_b 5.61109181
_cell_length_c 22.067731
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999779999999
_space_group_name_H-M_alt... |
DeleteAroundAtomAction | 4e459762-c4ad-4f27-903d-a10ab6874d37 | mp-759328 | Delete all atoms within 3.912 angstrom around the atom at index 33 in the cif file. | data_image0
_chemical_formula_structural Li4Ti4V6O20
_chemical_formula_sum "Li4 Ti4 V6 O20"
_cell_length_a 5.14849813
_cell_length_b 7.73748258
_cell_length_c 10.46219472
_cell_angle_alpha 104.39594751
_cell_angle_beta 103.46170253
_cell_angle_gamma 78.20151557
_space_gro... | data_image0
_chemical_formula_structural Li2TiV3O9
_chemical_formula_sum "Li2 Ti1 V3 O9"
_cell_length_a 5.14849813
_cell_length_b 7.73748258
_cell_length_c 10.46219472
_cell_angle_alpha 104.39594751
_cell_angle_beta 103.46170253
_cell_angle_gamma 78.20151557
_space_group_... |
DeleteAroundAtomAction | 93a9df87-b873-4352-be2f-5ee7bdb35f2d | mp-1217947 | Delete all atoms within 3.768 angstrom around the atom at index 37 in the cif file. | data_image0
_chemical_formula_structural Ta4Nb4Ag8O24
_chemical_formula_sum "Ta4 Nb4 Ag8 O24"
_cell_length_a 5.614271
_cell_length_b 5.686728
_cell_length_c 15.851884
_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 Ta3Nb3Ag4O15
_chemical_formula_sum "Ta3 Nb3 Ag4 O15"
_cell_length_a 5.614271
_cell_length_b 5.686728
_cell_length_c 15.851884
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_s... |
DeleteAroundAtomAction | e039f1a5-9e1c-4189-9735-7d4ee086d3ca | mp-17728 | Delete all atoms within 3.178 angstrom around the atom at index 7 in the cif file. | data_image0
_chemical_formula_structural Ta12Ge4
_chemical_formula_sum "Ta12 Ge4"
_cell_length_a 5.16276376
_cell_length_b 7.76695316
_cell_length_c 7.766400059999999
_cell_angle_alpha 83.6458981
_cell_angle_beta 70.5954467
_cell_angle_gamma 70.59385505
_space_group_name_... | data_image0
_chemical_formula_structural Ta5Ge
_chemical_formula_sum "Ta5 Ge1"
_cell_length_a 5.16276376
_cell_length_b 7.76695316
_cell_length_c 7.766400059999999
_cell_angle_alpha 83.6458981
_cell_angle_beta 70.5954467
_cell_angle_gamma 70.59385505
_space_group_name_H-M... |
DeleteAroundAtomAction | efd48841-045b-41ef-8651-d896155977f0 | mp-1191384 | Delete all atoms within 3.212 angstrom around the atom at index 23 in the cif file. | data_image0
_chemical_formula_structural Ca4B8H12
_chemical_formula_sum "Ca4 B8 H12"
_cell_length_a 3.639707
_cell_length_b 3.54837387
_cell_length_c 16.44897779
_cell_angle_alpha 90.92026841
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... | data_image0
_chemical_formula_structural Ca3B6H8
_chemical_formula_sum "Ca3 B6 H8"
_cell_length_a 3.639707
_cell_length_b 3.54837387
_cell_length_c 16.44897779
_cell_angle_alpha 90.92026841
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_s... |
DeleteAroundAtomAction | 5952cfa7-4ae6-4bcc-9ced-6a04c65e3e86 | mp-1213000 | Delete all atoms within 2.712 angstrom around the atom at index 14 in the cif file. | data_image0
_chemical_formula_structural Eu2Ag2W4O16
_chemical_formula_sum "Eu2 Ag2 W4 O16"
_cell_length_a 7.55169242
_cell_length_b 7.551692420000001
_cell_length_c 7.4675343
_cell_angle_alpha 65.51367922
_cell_angle_beta 65.51367922
_cell_angle_gamma 94.10381862
_space_... | data_image0
_chemical_formula_structural EuAg2W3O15
_chemical_formula_sum "Eu1 Ag2 W3 O15"
_cell_length_a 7.55169242
_cell_length_b 7.551692420000001
_cell_length_c 7.4675343
_cell_angle_alpha 65.51367922
_cell_angle_beta 65.51367922
_cell_angle_gamma 94.10381862
_space_g... |
DeleteAroundAtomAction | 312ee8bb-a535-49b6-97d2-b62b2b4cc88f | mp-989551 | Delete all atoms within 3.558 angstrom around the atom at index 7 in the cif file. | data_image0
_chemical_formula_structural LiTl2InF6
_chemical_formula_sum "Li1 Tl2 In1 F6"
_cell_length_a 6.05849797
_cell_length_b 6.05849797
_cell_length_c 6.05849797
_cell_angle_alpha 59.999999999999986
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.999999999999... | data_image0
_chemical_formula_structural F
_chemical_formula_sum "F1"
_cell_length_a 6.05849797
_cell_length_b 6.05849797
_cell_length_c 6.05849797
_cell_angle_alpha 59.999999999999986
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999
_space_group_nam... |
DeleteAroundAtomAction | 7466e3a6-aa38-4c48-8ec5-59b804f20159 | mp-779858 | Delete all atoms within 3.948 angstrom around the atom at index 19 in the cif file. | data_image0
_chemical_formula_structural Sm12Nb4O28
_chemical_formula_sum "Sm12 Nb4 O28"
_cell_length_a 7.6038
_cell_length_b 7.722814
_cell_length_c 10.832305
_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 Sm8Nb3O17
_chemical_formula_sum "Sm8 Nb3 O17"
_cell_length_a 7.6038
_cell_length_b 7.722814
_cell_length_c 10.832305
_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... |
DeleteAroundAtomAction | df2cd8b1-c19a-4fae-8e9e-55628f68fe2e | mp-1022594 | Delete all atoms within 3.688 angstrom around the atom at index 0 in the cif file. | data_image0
_chemical_formula_structural Mg12Zn2Ga2
_chemical_formula_sum "Mg12 Zn2 Ga2"
_cell_length_a 4.935307
_cell_length_b 6.310967
_cell_length_c 10.63879
_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 Mg7
_chemical_formula_sum "Mg7"
_cell_length_a 4.935307
_cell_length_b 6.310967
_cell_length_c 10.63879
_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_IT_number ... |
DeleteAroundAtomAction | 2aa145e0-cb7b-4756-a02c-e8206e6d2611 | mp-2226940 | Delete all atoms within 3.737 angstrom around the atom at index 14 in the cif file. | data_image0
_chemical_formula_structural MgZn2Ni4O8
_chemical_formula_sum "Mg1 Zn2 Ni4 O8"
_cell_length_a 6.24496673
_cell_length_b 5.848643550000001
_cell_length_c 5.85074879
_cell_angle_alpha 59.87032730000001
_cell_angle_beta 61.83354084
_cell_angle_gamma 61.98039920000... | data_image0
_chemical_formula_structural O
_chemical_formula_sum "O1"
_cell_length_a 6.24496673
_cell_length_b 5.848643550000001
_cell_length_c 5.85074879
_cell_angle_alpha 59.87032730000001
_cell_angle_beta 61.83354084
_cell_angle_gamma 61.98039920000001
_space_group_nam... |
DeleteAroundAtomAction | 8845d703-eca3-45ba-96c0-c0fb003ffc1d | mp-1226097 | Delete all atoms within 3.093 angstrom around the atom at index 9 in the cif file. | data_image0
_chemical_formula_structural Cr6Co2CuSe12
_chemical_formula_sum "Cr6 Co2 Cu1 Se12"
_cell_length_a 6.6299315
_cell_length_b 6.6299315
_cell_length_c 17.09676531
_cell_angle_alpha 78.33097976
_cell_angle_beta 78.33097976
_cell_angle_gamma 32.12505987
_space_grou... | data_image0
_chemical_formula_structural Cr4CoCuSe11
_chemical_formula_sum "Cr4 Co1 Cu1 Se11"
_cell_length_a 6.6299315
_cell_length_b 6.6299315
_cell_length_c 17.09676531
_cell_angle_alpha 78.33097976
_cell_angle_beta 78.33097976
_cell_angle_gamma 32.12505987
_space_group... |
DeleteAroundAtomAction | 2c78dc7c-ef65-4993-a536-30aed14766f5 | mp-1523289 | Delete all atoms within 2.448 angstrom around the atom at index 3 in the cif file. | data_image0
_chemical_formula_structural BaCaSn4O12
_chemical_formula_sum "Ba1 Ca1 Sn4 O12"
_cell_length_a 5.80842052
_cell_length_b 5.808420519999999
_cell_length_c 8.17261522
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 89.94865429999999
_space_group_n... | data_image0
_chemical_formula_structural BaCaSn3O6
_chemical_formula_sum "Ba1 Ca1 Sn3 O6"
_cell_length_a 5.80842052
_cell_length_b 5.808420519999999
_cell_length_c 8.17261522
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 89.94865429999999
_space_group_nam... |
DeleteAroundAtomAction | 6b849cdc-2487-45b0-9e15-d6032fc1572d | mp-1206898 | Delete all atoms within 3.427 angstrom around the atom at index 2 in the cif file. | data_image0
_chemical_formula_structural Y4In2Ge4
_chemical_formula_sum "Y4 In2 Ge4"
_cell_length_a 4.164073
_cell_length_b 7.434116
_cell_length_c 7.434116
_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 Y3In2Ge
_chemical_formula_sum "Y3 In2 Ge1"
_cell_length_a 4.164073
_cell_length_b 7.434116
_cell_length_c 7.434116
_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_... |
DeleteAroundAtomAction | ff5b7c31-727c-480a-8f18-2d4e3e532710 | mp-1214060 | Delete all atoms within 2.713 angstrom around the atom at index 35 in the cif file. | data_image0
_chemical_formula_structural Ca2Mg10P6H2C2O32
_chemical_formula_sum "Ca2 Mg10 P6 H2 C2 O32"
_cell_length_a 6.385735
_cell_length_b 8.7735602
_cell_length_c 10.933108059999999
_cell_angle_alpha 94.93399089
_cell_angle_beta 100.99475019
_cell_angle_gamma 93.15584... | data_image0
_chemical_formula_structural Ca2Mg8P5H2C2O27
_chemical_formula_sum "Ca2 Mg8 P5 H2 C2 O27"
_cell_length_a 6.385735
_cell_length_b 8.7735602
_cell_length_c 10.933108059999999
_cell_angle_alpha 94.93399089
_cell_angle_beta 100.99475019
_cell_angle_gamma 93.1558424... |
DeleteAroundAtomAction | 6716a7b2-f407-4fcd-bb6e-b943de35174d | mp-558681 | Delete all atoms within 3.97 angstrom around the atom at index 15 in the cif file. | data_image0
_chemical_formula_structural P8Cl8O8F16
_chemical_formula_sum "P8 Cl8 O8 F16"
_cell_length_a 5.55295745
_cell_length_b 9.90794988
_cell_length_c 13.09894283
_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 P7Cl4O5F14
_chemical_formula_sum "P7 Cl4 O5 F14"
_cell_length_a 5.55295745
_cell_length_b 9.90794988
_cell_length_c 13.09894283
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... |
DeleteAroundAtomAction | a762b55b-7c94-40cb-b22a-7a297ea6220d | mp-1196193 | Delete all atoms within 3.311 angstrom around the atom at index 1 in the cif file. | data_image0
_chemical_formula_structural FeSn4H24C8Se10N2
_chemical_formula_sum "Fe1 Sn4 H24 C8 Se10 N2"
_cell_length_a 11.01614547
_cell_length_b 11.01614547
_cell_length_c 11.01614547
_cell_angle_alpha 123.33029273
_cell_angle_beta 123.33029273
_cell_angle_gamma 84.32248... | data_image0
_chemical_formula_structural FeSn3H24C8Se6N2
_chemical_formula_sum "Fe1 Sn3 H24 C8 Se6 N2"
_cell_length_a 11.01614547
_cell_length_b 11.01614547
_cell_length_c 11.01614547
_cell_angle_alpha 123.33029273
_cell_angle_beta 123.33029273
_cell_angle_gamma 84.3224831... |
DeleteAroundAtomAction | 6d9d7766-0fda-4ae3-bea1-88345cb71f0c | mp-510581 | Delete all atoms within 3.106 angstrom around the atom at index 3 in the cif file. | data_image0
_chemical_formula_structural Pr2Ni2Sn2H4
_chemical_formula_sum "Pr2 Ni2 Sn2 H4"
_cell_length_a 4.41130012
_cell_length_b 4.41130012
_cell_length_c 8.566317
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000177
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Pr2NiSnH2
_chemical_formula_sum "Pr2 Ni1 Sn1 H2"
_cell_length_a 4.41130012
_cell_length_b 4.41130012
_cell_length_c 8.566317
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000177
_space_group_name_H-M_alt "... |
DeleteAroundAtomAction | e13a34b6-18e2-4b93-90d5-bfad8b1de41a | mp-862893 | Delete all atoms within 3.831 angstrom around the atom at index 20 in the cif file. | data_image0
_chemical_formula_structural Th3Nb12O36
_chemical_formula_sum "Th3 Nb12 O36"
_cell_length_a 11.97588008
_cell_length_b 11.97588008
_cell_length_c 11.97588008
_cell_angle_alpha 152.94345047
_cell_angle_beta 96.08688022
_cell_angle_gamma 90.19512719
_space_group... | data_image0
_chemical_formula_structural Th2Nb10O26
_chemical_formula_sum "Th2 Nb10 O26"
_cell_length_a 11.97588008
_cell_length_b 11.97588008
_cell_length_c 11.97588008
_cell_angle_alpha 152.94345047
_cell_angle_beta 96.08688022
_cell_angle_gamma 90.19512719
_space_group... |
DeleteAroundAtomAction | eecff96b-282a-4732-b6c6-6b8de77251e1 | mp-1205145 | Delete all atoms within 3.331 angstrom around the atom at index 9 in the cif file. | data_image0
_chemical_formula_structural Na8Ti4Si16H8O52
_chemical_formula_sum "Na8 Ti4 Si16 H8 O52"
_cell_length_a 7.446428
_cell_length_b 8.787016
_cell_length_c 16.530264
_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 Na6Ti3Si14H8O46
_chemical_formula_sum "Na6 Ti3 Si14 H8 O46"
_cell_length_a 7.446428
_cell_length_b 8.787016
_cell_length_c 16.530264
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... |
DeleteAroundAtomAction | a150ee34-8959-46fc-8b79-a83a4904d33a | mp-768771 | Delete all atoms within 2.13 angstrom around the atom at index 3 in the cif file. | 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 Li11Bi4B8O22
_chemical_formula_sum "Li11 Bi4 B8 O22"
_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_... |
DeleteAroundAtomAction | e0321352-1c6a-44b7-854a-637c7e496a80 | mp-1205906 | Delete all atoms within 3.923 angstrom around the atom at index 0 in the cif file. | data_image0
_chemical_formula_structural K2Mn2I2O12
_chemical_formula_sum "K2 Mn2 I2 O12"
_cell_length_a 5.12804591
_cell_length_b 5.12804591
_cell_length_c 12.256575
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999880000001
_space_group_name_H-M_a... | data_image0
_chemical_formula_structural KMn2I2O6
_chemical_formula_sum "K1 Mn2 I2 O6"
_cell_length_a 5.12804591
_cell_length_b 5.12804591
_cell_length_c 12.256575
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999880000001
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | cc203ef7-d54d-44d7-8f27-d152583d444f | mp-1211461 | Delete all atoms within 3.657 angstrom around the atom at index 28 in the cif file. | data_image0
_chemical_formula_structural K4Li4Dy4F20
_chemical_formula_sum "K4 Li4 Dy4 F20"
_cell_length_a 6.43494672
_cell_length_b 6.26276227
_cell_length_c 11.66117988
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 113.58188199999998
_space_group_name_H... | data_image0
_chemical_formula_structural K2Li2Dy3F10
_chemical_formula_sum "K2 Li2 Dy3 F10"
_cell_length_a 6.43494672
_cell_length_b 6.26276227
_cell_length_c 11.66117988
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 113.58188199999998
_space_group_name_H... |
DeleteAroundAtomAction | 3ef4a677-b215-4d67-998c-cc35ff8f6744 | mp-2824 | Delete all atoms within 3.27 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural Al4Pd8
_chemical_formula_sum "Al4 Pd8"
_cell_length_a 4.07169292
_cell_length_b 5.41975902
_cell_length_c 7.81286848
_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 AlPd2
_chemical_formula_sum "Al1 Pd2"
_cell_length_a 4.07169292
_cell_length_b 5.41975902
_cell_length_c 7.81286848
_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... |
DeleteAroundAtomAction | 7ba99a29-c3c6-40ca-af79-a34b3de1a958 | mp-1046251 | Delete all atoms within 2.533 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural Ta4Zn4W2O16
_chemical_formula_sum "Ta4 Zn4 W2 O16"
_cell_length_a 5.344397
_cell_length_b 5.98332699
_cell_length_c 10.2602083
_cell_angle_alpha 105.03537055
_cell_angle_beta 90.73260924999998
_cell_angle_gamma 91.18839774
_space_g... | data_image0
_chemical_formula_structural Ta4Zn3W2O11
_chemical_formula_sum "Ta4 Zn3 W2 O11"
_cell_length_a 5.344397
_cell_length_b 5.98332699
_cell_length_c 10.2602083
_cell_angle_alpha 105.03537055
_cell_angle_beta 90.73260924999998
_cell_angle_gamma 91.18839774
_space_g... |
DeleteAroundAtomAction | 8baefa80-2766-4ad4-ad9a-dceddc647702 | mp-754378 | Delete all atoms within 2.707 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural Li2V6O8
_chemical_formula_sum "Li2 V6 O8"
_cell_length_a 6.08297738
_cell_length_b 5.97776458
_cell_length_c 5.977791540000001
_cell_angle_alpha 90.21968224999999
_cell_angle_beta 60.204871139999995
_cell_angle_gamma 119.79534081
_... | data_image0
_chemical_formula_structural Li2V5O2
_chemical_formula_sum "Li2 V5 O2"
_cell_length_a 6.08297738
_cell_length_b 5.97776458
_cell_length_c 5.977791540000001
_cell_angle_alpha 90.21968224999999
_cell_angle_beta 60.204871139999995
_cell_angle_gamma 119.79534081
_... |
DeleteAroundAtomAction | b2030e71-2ba8-43f0-8d8f-5190c4da2337 | mp-17446 | Delete all atoms within 3.278 angstrom around the atom at index 11 in the cif file. | data_image0
_chemical_formula_structural Pr4Pt4F28
_chemical_formula_sum "Pr4 Pt4 F28"
_cell_length_a 5.55250346
_cell_length_b 9.16738669
_cell_length_c 12.29216205
_cell_angle_alpha 61.48286727
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Pr3Pt3F19
_chemical_formula_sum "Pr3 Pt3 F19"
_cell_length_a 5.55250346
_cell_length_b 9.16738669
_cell_length_c 12.29216205
_cell_angle_alpha 61.48286727
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
DeleteAroundAtomAction | 7210c4c1-a793-4bd9-9046-f36cc9424e67 | mp-1079383 | Delete all atoms within 2.946 angstrom around the atom at index 3 in the cif file. | data_image0
_chemical_formula_structural Ce4In2Cu4
_chemical_formula_sum "Ce4 In2 Cu4"
_cell_length_a 8.380093
_cell_length_b 8.380093
_cell_length_c 3.154539
_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 Ce2In2Cu
_chemical_formula_sum "Ce2 In2 Cu1"
_cell_length_a 8.380093
_cell_length_b 8.380093
_cell_length_c 3.154539
_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... |
DeleteAroundAtomAction | ea2661d3-6fa3-4c82-ad3b-e6ec83917a70 | mp-2223616 | Delete all atoms within 2.519 angstrom around the atom at index 9 in the cif file. | data_image0
_chemical_formula_structural MgCuH4O2F2
_chemical_formula_sum "Mg1 Cu1 H4 O2 F2"
_cell_length_a 3.24414608
_cell_length_b 6.20873788
_cell_length_c 6.208736580000001
_cell_angle_alpha 93.90489924999999
_cell_angle_beta 107.42928971
_cell_angle_gamma 107.4292979... | data_image0
_chemical_formula_structural CuH2OF
_chemical_formula_sum "Cu1 H2 O1 F1"
_cell_length_a 3.24414608
_cell_length_b 6.20873788
_cell_length_c 6.208736580000001
_cell_angle_alpha 93.90489924999999
_cell_angle_beta 107.42928971
_cell_angle_gamma 107.42929792
_spac... |
DeleteAroundAtomAction | 66107af0-3ae3-4d87-a6a4-093b709e8e67 | mp-757276 | Delete all atoms within 3.502 angstrom around the atom at index 15 in the cif file. | data_image0
_chemical_formula_structural Li6Ti4P6O24
_chemical_formula_sum "Li6 Ti4 P6 O24"
_cell_length_a 4.96862546
_cell_length_b 4.96862546
_cell_length_c 18.6147344
_cell_angle_alpha 89.63124619
_cell_angle_beta 89.63124619
_cell_angle_gamma 66.84018246
_space_group_... | data_image0
_chemical_formula_structural Li3Ti3P5O18
_chemical_formula_sum "Li3 Ti3 P5 O18"
_cell_length_a 4.96862546
_cell_length_b 4.96862546
_cell_length_c 18.6147344
_cell_angle_alpha 89.63124619
_cell_angle_beta 89.63124619
_cell_angle_gamma 66.84018246
_space_group_... |
DeleteAroundAtomAction | c20d8396-68af-475a-bb3a-9e221ed002c5 | mp-1199851 | Delete all atoms within 3.22 angstrom around the atom at index 27 in the cif file. | data_image0
_chemical_formula_structural Er4C12O32
_chemical_formula_sum "Er4 C12 O32"
_cell_length_a 7.231529
_cell_length_b 8.885058
_cell_length_c 12.686882
_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 Er3C9O26
_chemical_formula_sum "Er3 C9 O26"
_cell_length_a 7.231529
_cell_length_b 8.885058
_cell_length_c 12.686882
_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... |
DeleteAroundAtomAction | 017fef7e-6820-41a7-a9fa-f00994245e23 | mp-760314 | Delete all atoms within 3.945 angstrom around the atom at index 18 in the cif file. | data_image0
_chemical_formula_structural V6O5F19
_chemical_formula_sum "V6 O5 F19"
_cell_length_a 5.357245
_cell_length_b 5.49728866
_cell_length_c 14.92364534
_cell_angle_alpha 100.56613557999998
_cell_angle_beta 89.65687162
_cell_angle_gamma 92.05213902999999
_space_gro... | data_image0
_chemical_formula_structural V4O2F11
_chemical_formula_sum "V4 O2 F11"
_cell_length_a 5.357245
_cell_length_b 5.49728866
_cell_length_c 14.92364534
_cell_angle_alpha 100.56613557999998
_cell_angle_beta 89.65687162
_cell_angle_gamma 92.05213902999999
_space_gro... |
DeleteAroundAtomAction | 786e0b1c-4332-43d2-8676-1c41391c0b4f | mp-1219511 | Delete all atoms within 2.373 angstrom around the atom at index 16 in the cif file. | data_image0
_chemical_formula_structural Sb4O16
_chemical_formula_sum "Sb4 O16"
_cell_length_a 7.37775671
_cell_length_b 7.377756709999999
_cell_length_c 7.37775671
_cell_angle_alpha 120.42942317
_cell_angle_beta 119.88450821
_cell_angle_gamma 89.72899265999999
_space_gro... | data_image0
_chemical_formula_structural Sb4O13
_chemical_formula_sum "Sb4 O13"
_cell_length_a 7.37775671
_cell_length_b 7.377756709999999
_cell_length_c 7.37775671
_cell_angle_alpha 120.42942317
_cell_angle_beta 119.88450821
_cell_angle_gamma 89.72899265999999
_space_gro... |
DeleteAroundAtomAction | 3abdd91c-da8a-42b7-b4bf-a2476c530e3d | mp-1235023 | Delete all atoms within 3.124 angstrom around the atom at index 9 in the cif file. | data_image0
_chemical_formula_structural LiZn2Fe4O8
_chemical_formula_sum "Li1 Zn2 Fe4 O8"
_cell_length_a 6.1557658
_cell_length_b 6.155765599999999
_cell_length_c 5.91697548
_cell_angle_alpha 61.27510906
_cell_angle_beta 61.27511007999999
_cell_angle_gamma 57.266703329999... | data_image0
_chemical_formula_structural ZnFeO
_chemical_formula_sum "Zn1 Fe1 O1"
_cell_length_a 6.1557658
_cell_length_b 6.155765599999999
_cell_length_c 5.91697548
_cell_angle_alpha 61.27510906
_cell_angle_beta 61.27511007999999
_cell_angle_gamma 57.266703329999984
_spa... |
DeleteAroundAtomAction | f90e749c-9d1a-48fc-a283-a8f504c14e1d | mp-1276828 | Delete all atoms within 3.144 angstrom around the atom at index 13 in the cif file. | data_image0
_chemical_formula_structural Sr4La4Co4O16
_chemical_formula_sum "Sr4 La4 Co4 O16"
_cell_length_a 3.8627761
_cell_length_b 15.026006669999997
_cell_length_c 6.829179679999999
_cell_angle_alpha 80.67448944999998
_cell_angle_beta 106.36904066999999
_cell_angle_gamma ... | data_image0
_chemical_formula_structural Sr3La2Co3O12
_chemical_formula_sum "Sr3 La2 Co3 O12"
_cell_length_a 3.8627761
_cell_length_b 15.026006669999997
_cell_length_c 6.829179679999999
_cell_angle_alpha 80.67448944999998
_cell_angle_beta 106.36904066999999
_cell_angle_gamma ... |
DeleteAroundAtomAction | 12f23ae6-020f-45bb-9e5b-d0ebe80450a6 | mp-1224390 | Delete all atoms within 2.933 angstrom around the atom at index 2 in the cif file. | data_image0
_chemical_formula_structural HfAu9
_chemical_formula_sum "Hf1 Au9"
_cell_length_a 5.0602821
_cell_length_b 5.0602821
_cell_length_c 9.40062687
_cell_angle_alpha 88.11660357
_cell_angle_beta 88.11660357
_cell_angle_gamma 47.58412455
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural HfAu5
_chemical_formula_sum "Hf1 Au5"
_cell_length_a 5.0602821
_cell_length_b 5.0602821
_cell_length_c 9.40062687
_cell_angle_alpha 88.11660357
_cell_angle_beta 88.11660357
_cell_angle_gamma 47.58412455
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | b8c088e0-bad7-4c03-b171-9abbb22b0651 | mp-776479 | Delete all atoms within 3.086 angstrom around the atom at index 28 in the cif file. | data_image0
_chemical_formula_structural Ba8Y8I40
_chemical_formula_sum "Ba8 Y8 I40"
_cell_length_a 11.742243
_cell_length_b 13.92138
_cell_length_c 20.307581560000003
_cell_angle_alpha 51.23487621000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_a... | data_image0
_chemical_formula_structural Ba8Y7I39
_chemical_formula_sum "Ba8 Y7 I39"
_cell_length_a 11.742243
_cell_length_b 13.92138
_cell_length_c 20.307581560000003
_cell_angle_alpha 51.23487621000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_a... |
DeleteAroundAtomAction | ec33f429-aec6-4ddc-876a-5070fcdd4353 | mp-9855 | Delete all atoms within 2.432 angstrom around the atom at index 10 in the cif file. | data_image0
_chemical_formula_structural K2Hf2Cu2S6
_chemical_formula_sum "K2 Hf2 Cu2 S6"
_cell_length_a 3.732264
_cell_length_b 7.390573709999999
_cell_length_c 9.762009
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 104.62559602000002
_space_group_name_H... | data_image0
_chemical_formula_structural K2Hf2CuS5
_chemical_formula_sum "K2 Hf2 Cu1 S5"
_cell_length_a 3.732264
_cell_length_b 7.390573709999999
_cell_length_c 9.762009
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 104.62559602000002
_space_group_name_H-... |
DeleteAroundAtomAction | 664d7e3a-c519-405f-aade-9551e12dfaed | mp-2240631 | Delete all atoms within 2.406 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural MgTiCo2O6
_chemical_formula_sum "Mg1 Ti1 Co2 O6"
_cell_length_a 6.46033923
_cell_length_b 2.9798687099999994
_cell_length_c 6.017675279999999
_cell_angle_alpha 91.69648976
_cell_angle_beta 101.10467135
_cell_angle_gamma 76.95590099
... | data_image0
_chemical_formula_structural MgCoO5
_chemical_formula_sum "Mg1 Co1 O5"
_cell_length_a 6.46033923
_cell_length_b 2.9798687099999994
_cell_length_c 6.017675279999999
_cell_angle_alpha 91.69648976
_cell_angle_beta 101.10467135
_cell_angle_gamma 76.95590099
_space... |
DeleteAroundAtomAction | 880aef46-39fc-415a-ba4e-fc3a73a6a22c | mp-1223327 | Delete all atoms within 1.842 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural La4C2O10
_chemical_formula_sum "La4 C2 O10"
_cell_length_a 4.09957479
_cell_length_b 4.09957479
_cell_length_c 15.98046
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.24407791
_space_group_name_H-M_alt "P 1"
... | data_image0
_chemical_formula_structural La4CO7
_chemical_formula_sum "La4 C1 O7"
_cell_length_a 4.09957479
_cell_length_b 4.09957479
_cell_length_c 15.98046
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.24407791
_space_group_name_H-M_alt "P 1"
_sp... |
DeleteAroundAtomAction | 2cffa0f0-7a53-48be-bc5d-b434a0d9928f | mp-20461 | Delete all atoms within 3.819 angstrom around the atom at index 1 in the cif file. | data_image0
_chemical_formula_structural Ba2Pb2O6
_chemical_formula_sum "Ba2 Pb2 O6"
_cell_length_a 6.15036645
_cell_length_b 6.15036645
_cell_length_c 6.13110795
_cell_angle_alpha 60.233741280000004
_cell_angle_beta 60.233741280000004
_cell_angle_gamma 89.75035477
_space... | data_image0
_chemical_formula_structural Ba
_chemical_formula_sum "Ba1"
_cell_length_a 6.15036645
_cell_length_b 6.15036645
_cell_length_c 6.13110795
_cell_angle_alpha 60.233741280000004
_cell_angle_beta 60.233741280000004
_cell_angle_gamma 89.75035477
_space_group_name_H... |
DeleteAroundAtomAction | f4b39d77-9140-4c88-bf6c-bee41f9d440b | mp-738612 | Delete all atoms within 3.877 angstrom around the atom at index 36 in the cif file. | data_image0
_chemical_formula_structural Zn2H32C6N16O14
_chemical_formula_sum "Zn2 H32 C6 N16 O14"
_cell_length_a 8.21034901
_cell_length_b 8.210349010000002
_cell_length_c 10.52835642
_cell_angle_alpha 67.70202015
_cell_angle_beta 67.70202015
_cell_angle_gamma 83.08920301... | data_image0
_chemical_formula_structural ZnH17C5N10O9
_chemical_formula_sum "Zn1 H17 C5 N10 O9"
_cell_length_a 8.21034901
_cell_length_b 8.210349010000002
_cell_length_c 10.52835642
_cell_angle_alpha 67.70202015
_cell_angle_beta 67.70202015
_cell_angle_gamma 83.08920301
_... |
DeleteAroundAtomAction | 522092d3-ea35-4489-8cc1-0ce9f8ef7ae4 | mp-1192032 | Delete all atoms within 2.567 angstrom around the atom at index 5 in the cif file. | data_image0
_chemical_formula_structural NaSr3Be3B3O9F4
_chemical_formula_sum "Na1 Sr3 Be3 B3 O9 F4"
_cell_length_a 6.76163682
_cell_length_b 6.761636819999999
_cell_length_c 6.76163698
_cell_angle_alpha 103.68584915
_cell_angle_beta 103.68584915
_cell_angle_gamma 103.6858... | data_image0
_chemical_formula_structural NaSr3Be2B2O6F3
_chemical_formula_sum "Na1 Sr3 Be2 B2 O6 F3"
_cell_length_a 6.76163682
_cell_length_b 6.761636819999999
_cell_length_c 6.76163698
_cell_angle_alpha 103.68584915
_cell_angle_beta 103.68584915
_cell_angle_gamma 103.6858... |
DeleteAroundAtomAction | 969493bb-eb0c-417e-8d67-b070dfd53026 | mp-1203429 | Delete all atoms within 3.556 angstrom around the atom at index 32 in the cif file. | data_image0
_chemical_formula_structural Tm8B24Os4
_chemical_formula_sum "Tm8 B24 Os4"
_cell_length_a 3.61183316
_cell_length_b 9.05426635
_cell_length_c 11.41713141
_cell_angle_alpha 90.00000214
_cell_angle_beta 90.00000165
_cell_angle_gamma 89.99999971
_space_group_name... | data_image0
_chemical_formula_structural Tm3B19Os3
_chemical_formula_sum "Tm3 B19 Os3"
_cell_length_a 3.61183316
_cell_length_b 9.05426635
_cell_length_c 11.41713141
_cell_angle_alpha 90.00000214
_cell_angle_beta 90.00000165
_cell_angle_gamma 89.99999971
_space_group_name... |
DeleteAroundAtomAction | f63ae529-c47c-4f77-8a23-7993ccbc4e63 | mp-1101765 | Delete all atoms within 3.753 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural Bi4Rh4Se4
_chemical_formula_sum "Bi4 Rh4 Se4"
_cell_length_a 6.34286969
_cell_length_b 6.34286969
_cell_length_c 6.34286969
_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 BiRh3Se
_chemical_formula_sum "Bi1 Rh3 Se1"
_cell_length_a 6.34286969
_cell_length_b 6.34286969
_cell_length_c 6.34286969
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_space... |
DeleteAroundAtomAction | 22ff1652-7426-4bb3-86b7-debe47b7f5a6 | mp-21286 | Delete all atoms within 2.648 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural Mn4Co4Ge4
_chemical_formula_sum "Mn4 Co4 Ge4"
_cell_length_a 3.82385196
_cell_length_b 5.9037076
_cell_length_c 6.901116699999999
_cell_angle_alpha 89.99795725
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Mn4Co3Ge
_chemical_formula_sum "Mn4 Co3 Ge1"
_cell_length_a 3.82385196
_cell_length_b 5.9037076
_cell_length_c 6.901116699999999
_cell_angle_alpha 89.99795725
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | 0de3a06e-282c-4425-b019-fad29b5ff772 | mp-31027 | Delete all atoms within 2.895 angstrom around the atom at index 27 in the cif file. | data_image0
_chemical_formula_structural Sc12Re8Si16
_chemical_formula_sum "Sc12 Re8 Si16"
_cell_length_a 10.15633872
_cell_length_b 10.15633872
_cell_length_c 13.69314321
_cell_angle_alpha 55.95864628999999
_cell_angle_beta 55.95864628999999
_cell_angle_gamma 30.586560140... | data_image0
_chemical_formula_structural Sc9Re4Si14
_chemical_formula_sum "Sc9 Re4 Si14"
_cell_length_a 10.15633872
_cell_length_b 10.15633872
_cell_length_c 13.69314321
_cell_angle_alpha 55.95864628999999
_cell_angle_beta 55.95864628999999
_cell_angle_gamma 30.58656014000... |
DeleteAroundAtomAction | 1abfd025-0fef-4f26-861a-1b1c9cb71db4 | mp-1219272 | Delete all atoms within 2.896 angstrom around the atom at index 25 in the cif file. | data_image0
_chemical_formula_structural Sm4CrFe33C4
_chemical_formula_sum "Sm4 Cr1 Fe33 C4"
_cell_length_a 6.50403639
_cell_length_b 6.48021192
_cell_length_c 13.00634797
_cell_angle_alpha 83.55663481
_cell_angle_beta 83.5493849
_cell_angle_gamma 83.68356637
_space_group... | data_image0
_chemical_formula_structural Sm4CrFe22C4
_chemical_formula_sum "Sm4 Cr1 Fe22 C4"
_cell_length_a 6.50403639
_cell_length_b 6.48021192
_cell_length_c 13.00634797
_cell_angle_alpha 83.55663481
_cell_angle_beta 83.5493849
_cell_angle_gamma 83.68356637
_space_group... |
DeleteAroundAtomAction | 6bff370f-74d9-41cb-b205-65b7cfff4e20 | mp-1191177 | Delete all atoms within 2.443 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural Tb4Co14B6
_chemical_formula_sum "Tb4 Co14 B6"
_cell_length_a 5.03978762
_cell_length_b 5.03749468
_cell_length_c 12.725759999999998
_cell_angle_alpha 89.99993873
_cell_angle_beta 90.00011549
_cell_angle_gamma 120.0150517
_space_gro... | data_image0
_chemical_formula_structural Tb4Co13B4
_chemical_formula_sum "Tb4 Co13 B4"
_cell_length_a 5.03978762
_cell_length_b 5.03749468
_cell_length_c 12.725759999999998
_cell_angle_alpha 89.99993873
_cell_angle_beta 90.00011549
_cell_angle_gamma 120.0150517
_space_gro... |
DeleteAroundAtomAction | 792db4b5-a6d3-4afc-89f8-c42f747bd3ba | mp-753244 | Delete all atoms within 3.285 angstrom around the atom at index 23 in the cif file. | data_image0
_chemical_formula_structural Li2Mn4F18
_chemical_formula_sum "Li2 Mn4 F18"
_cell_length_a 5.222341
_cell_length_b 5.26049537
_cell_length_c 14.59818153
_cell_angle_alpha 92.04736841
_cell_angle_beta 93.58591976000001
_cell_angle_gamma 118.71798806
_space_group... | data_image0
_chemical_formula_structural LiMn3F11
_chemical_formula_sum "Li1 Mn3 F11"
_cell_length_a 5.222341
_cell_length_b 5.26049537
_cell_length_c 14.59818153
_cell_angle_alpha 92.04736841
_cell_angle_beta 93.58591976000001
_cell_angle_gamma 118.71798806
_space_group_... |
DeleteAroundAtomAction | 81e41db7-d193-498d-8a75-34f2d3ad0018 | mp-600039 | Delete all atoms within 2.273 angstrom around the atom at index 49 in the cif file. | data_image0
_chemical_formula_structural Si24O48
_chemical_formula_sum "Si24 O48"
_cell_length_a 15.8848319
_cell_length_b 9.52246335
_cell_length_c 8.55610682
_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 Si22O47
_chemical_formula_sum "Si22 O47"
_cell_length_a 15.8848319
_cell_length_b 9.52246335
_cell_length_c 8.55610682
_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... |
DeleteAroundAtomAction | 627afb05-71d1-4a0d-ab07-d6eb0e0cbce2 | mp-19488 | Delete all atoms within 1.884 angstrom around the atom at index 33 in the cif file. | data_image0
_chemical_formula_structural Rb8Mn4S4O16F12
_chemical_formula_sum "Rb8 Mn4 S4 O16 F12"
_cell_length_a 11.366418
_cell_length_b 7.482206
_cell_length_c 8.94542962
_cell_angle_alpha 86.77934557999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name... | data_image0
_chemical_formula_structural Rb8Mn3S4O16F11
_chemical_formula_sum "Rb8 Mn3 S4 O16 F11"
_cell_length_a 11.366418
_cell_length_b 7.482206
_cell_length_c 8.94542962
_cell_angle_alpha 86.77934557999998
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name... |
DeleteAroundAtomAction | 1d7f5445-fce2-498b-a6a1-14b321cc0c0c | mp-1211033 | Delete all atoms within 3.807 angstrom around the atom at index 0 in the cif file. | data_image0
_chemical_formula_structural Lu12In2Fe3
_chemical_formula_sum "Lu12 In2 Fe3"
_cell_length_a 8.15749244
_cell_length_b 8.15748797
_cell_length_c 8.15752811
_cell_angle_alpha 108.89905187
_cell_angle_beta 108.89905825
_cell_angle_gamma 110.62113047000001
_space_... | data_image0
_chemical_formula_structural LuFe
_chemical_formula_sum "Lu1 Fe1"
_cell_length_a 8.15749244
_cell_length_b 8.15748797
_cell_length_c 8.15752811
_cell_angle_alpha 108.89905187
_cell_angle_beta 108.89905825
_cell_angle_gamma 110.62113047000001
_space_group_name_... |
DeleteAroundAtomAction | 2e787b4a-d247-4031-a858-77edbf1500f8 | mp-1206399 | Delete all atoms within 2.99 angstrom around the atom at index 6 in the cif file. | 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 Rb2Cl5
_chemical_formula_sum "Rb2 Cl5"
_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_H-M_alt ... |
DeleteAroundAtomAction | a03509c2-6c0f-48db-9f0f-75091e2a5d6a | mp-11321 | Delete all atoms within 3.504 angstrom around the atom at index 1 in the cif file. | data_image0
_chemical_formula_structural Y6Ta2O14
_chemical_formula_sum "Y6 Ta2 O14"
_cell_length_a 6.44925603
_cell_length_b 6.449256029999999
_cell_length_c 7.43658817
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 108.90163995
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Y4TaO7
_chemical_formula_sum "Y4 Ta1 O7"
_cell_length_a 6.44925603
_cell_length_b 6.449256029999999
_cell_length_c 7.43658817
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 108.90163995
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | 878dde02-6c84-4ab4-ba4a-2d34505587bc | mp-555706 | Delete all atoms within 3.216 angstrom around the atom at index 37 in the cif file. | 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 Li3Al3Si3H8O13
_chemical_formula_sum "Li3 Al3 Si3 H8 O13"
_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 ... |
DeleteAroundAtomAction | ed562116-4828-49ce-9864-05a17f342603 | mp-19489 | Delete all atoms within 3.022 angstrom around the atom at index 63 in the cif file. | 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 Sm3Co4B14O32
_chemical_formula_sum "Sm3 Co4 B14 O32"
_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_... |
DeleteAroundAtomAction | c8d2af0d-ec48-4dae-93a0-e6b3fb9f2d67 | mp-556233 | Delete all atoms within 2.631 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural KAs4ClO6
_chemical_formula_sum "K1 As4 Cl1 O6"
_cell_length_a 5.25328503
_cell_length_b 5.25328503
_cell_length_c 8.94578662
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001252000001
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural KAs2ClO3
_chemical_formula_sum "K1 As2 Cl1 O3"
_cell_length_a 5.25328503
_cell_length_b 5.25328503
_cell_length_c 8.94578662
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00001252000001
_space_group_name_H-M_al... |
DeleteAroundAtomAction | ab8e474f-65d7-40e7-aee8-95f6d570f633 | mp-650121 | Delete all atoms within 3.181 angstrom around the atom at index 36 in the cif file. | data_image0
_chemical_formula_structural Li12Se6O24
_chemical_formula_sum "Li12 Se6 O24"
_cell_length_a 8.634345
_cell_length_b 9.07239497
_cell_length_c 9.08747216
_cell_angle_alpha 92.87802271
_cell_angle_beta 113.42088352
_cell_angle_gamma 104.85194428
_space_group_nam... | data_image0
_chemical_formula_structural Li10Se4O18
_chemical_formula_sum "Li10 Se4 O18"
_cell_length_a 8.634345
_cell_length_b 9.07239497
_cell_length_c 9.08747216
_cell_angle_alpha 92.87802271
_cell_angle_beta 113.42088352
_cell_angle_gamma 104.85194428
_space_group_nam... |
DeleteAroundAtomAction | fbb88b42-12e1-4d48-91e3-5f7fbcd982e7 | mp-1245725 | Delete all atoms within 2.382 angstrom around the atom at index 29 in the cif file. | data_image0
_chemical_formula_structural Sr12Ni8N16
_chemical_formula_sum "Sr12 Ni8 N16"
_cell_length_a 5.86012
_cell_length_b 9.996389
_cell_length_c 9.445696
_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 Sr12Ni6N15
_chemical_formula_sum "Sr12 Ni6 N15"
_cell_length_a 5.86012
_cell_length_b 9.996389
_cell_length_c 9.445696
_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... |
DeleteAroundAtomAction | 845cd1d6-faa4-4d29-9376-ce599987a7d3 | mp-1173734 | Delete all atoms within 3.053 angstrom around the atom at index 37 in the cif file. | data_image0
_chemical_formula_structural NaCa3Fe4Si8O24
_chemical_formula_sum "Na1 Ca3 Fe4 Si8 O24"
_cell_length_a 7.70031409
_cell_length_b 7.700314089999999
_cell_length_c 9.98506993
_cell_angle_alpha 62.79150036
_cell_angle_beta 62.79150036
_cell_angle_gamma 72.03905514... | data_image0
_chemical_formula_structural NaCaFe4Si6O16
_chemical_formula_sum "Na1 Ca1 Fe4 Si6 O16"
_cell_length_a 7.70031409
_cell_length_b 7.700314089999999
_cell_length_c 9.98506993
_cell_angle_alpha 62.79150036
_cell_angle_beta 62.79150036
_cell_angle_gamma 72.03905514
... |
DeleteAroundAtomAction | b669fb4c-277d-4f79-8435-f633d156d265 | mp-542830 | Delete all atoms within 3.39 angstrom around the atom at index 0 in the cif file. | data_image0
_chemical_formula_structural Mn23C6
_chemical_formula_sum "Mn23 C6"
_cell_length_a 7.42191675
_cell_length_b 7.42191123
_cell_length_c 7.42190135
_cell_angle_alpha 60.00005357000002
_cell_angle_beta 60.00007819000001
_cell_angle_gamma 60.001147960000004
_space... | data_image0
_chemical_formula_structural Mn10
_chemical_formula_sum "Mn10"
_cell_length_a 7.42191675
_cell_length_b 7.42191123
_cell_length_c 7.42190135
_cell_angle_alpha 60.00005357000002
_cell_angle_beta 60.00007819000001
_cell_angle_gamma 60.001147960000004
_space_grou... |
DeleteAroundAtomAction | 67e69869-12da-4fab-b2f6-36c338cda9ce | mp-2230054 | Delete all atoms within 3.14 angstrom around the atom at index 18 in the cif file. | data_image0
_chemical_formula_structural MgCu6O2F10
_chemical_formula_sum "Mg1 Cu6 O2 F10"
_cell_length_a 7.94494959
_cell_length_b 5.121785429999999
_cell_length_c 5.64517934
_cell_angle_alpha 95.16250544
_cell_angle_beta 92.9587146
_cell_angle_gamma 84.02053913999998
_s... | data_image0
_chemical_formula_structural Cu3OF3
_chemical_formula_sum "Cu3 O1 F3"
_cell_length_a 7.94494959
_cell_length_b 5.121785429999999
_cell_length_c 5.64517934
_cell_angle_alpha 95.16250544
_cell_angle_beta 92.9587146
_cell_angle_gamma 84.02053913999998
_space_grou... |
DeleteAroundAtomAction | b98e0404-43ae-42ad-82f4-c6e146d530aa | mp-2230007 | Delete all atoms within 3.606 angstrom around the atom at index 0 in the cif file. | data_image0
_chemical_formula_structural Cs4MgTi2Ag4S8
_chemical_formula_sum "Cs4 Mg1 Ti2 Ag4 S8"
_cell_length_a 6.33906844
_cell_length_b 6.339068440000001
_cell_length_c 13.70134139
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 84.22111217
_space_group_... | data_image0
_chemical_formula_structural Cs2Ti2Ag4S4
_chemical_formula_sum "Cs2 Ti2 Ag4 S4"
_cell_length_a 6.33906844
_cell_length_b 6.339068440000001
_cell_length_c 13.70134139
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 84.22111217
_space_group_name_H... |
DeleteAroundAtomAction | 02429bc2-cb5c-483e-8207-8a1d72140e24 | mp-31230 | Delete all atoms within 2.576 angstrom around the atom at index 10 in the cif file. | data_image0
_chemical_formula_structural Tl4Cr4O14
_chemical_formula_sum "Tl4 Cr4 O14"
_cell_length_a 7.535238
_cell_length_b 7.744585460000001
_cell_length_c 7.92364084
_cell_angle_alpha 108.10319573
_cell_angle_beta 91.47692726
_cell_angle_gamma 111.17845443000002
_spac... | data_image0
_chemical_formula_structural Tl4Cr3O13
_chemical_formula_sum "Tl4 Cr3 O13"
_cell_length_a 7.535238
_cell_length_b 7.744585460000001
_cell_length_c 7.92364084
_cell_angle_alpha 108.10319573
_cell_angle_beta 91.47692726
_cell_angle_gamma 111.17845443000002
_spac... |
DeleteAroundAtomAction | edbe0622-92d6-49ce-aee9-cbb1ddd7cdbc | mp-849387 | Delete all atoms within 2.481 angstrom around the atom at index 14 in the cif file. | data_image0
_chemical_formula_structural Cu6OF11
_chemical_formula_sum "Cu6 O1 F11"
_cell_length_a 3.19079291
_cell_length_b 13.70274985
_cell_length_c 4.57558502
_cell_angle_alpha 91.14804451000002
_cell_angle_beta 84.64664774000002
_cell_angle_gamma 90.962296
_space_gro... | data_image0
_chemical_formula_structural Cu4OF10
_chemical_formula_sum "Cu4 O1 F10"
_cell_length_a 3.19079291
_cell_length_b 13.70274985
_cell_length_c 4.57558502
_cell_angle_alpha 91.14804451000002
_cell_angle_beta 84.64664774000002
_cell_angle_gamma 90.962296
_space_gro... |
DeleteAroundAtomAction | a9bd58cd-088f-4bcd-a6d6-7648e7d3e749 | mp-1105094 | Delete all atoms within 2.783 angstrom around the atom at index 16 in the cif file. | data_image0
_chemical_formula_structural Tl4Hg4Cl12
_chemical_formula_sum "Tl4 Hg4 Cl12"
_cell_length_a 4.36965245
_cell_length_b 9.24800615
_cell_length_c 14.07342645
_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 Tl4Hg3Cl11
_chemical_formula_sum "Tl4 Hg3 Cl11"
_cell_length_a 4.36965245
_cell_length_b 9.24800615
_cell_length_c 14.07342645
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
DeleteAroundAtomAction | c818479f-aec4-4876-a258-7ac04cc1f2c9 | mp-676712 | Delete all atoms within 3.19 angstrom around the atom at index 28 in the cif file. | data_image0
_chemical_formula_structural Re12Se12Cl12
_chemical_formula_sum "Re12 Se12 Cl12"
_cell_length_a 9.3449135
_cell_length_b 9.34516927
_cell_length_c 11.316750129999999
_cell_angle_alpha 89.99556122
_cell_angle_beta 90.00237911999999
_cell_angle_gamma 103.78862754... | data_image0
_chemical_formula_structural Re10Se12Cl11
_chemical_formula_sum "Re10 Se12 Cl11"
_cell_length_a 9.3449135
_cell_length_b 9.34516927
_cell_length_c 11.316750129999999
_cell_angle_alpha 89.99556122
_cell_angle_beta 90.00237911999999
_cell_angle_gamma 103.78862754... |
DeleteAroundAtomAction | 2e8c62f7-dc2c-4487-bdc0-f8796f70f0be | mp-1234848 | Delete all atoms within 3.977 angstrom around the atom at index 13 in the cif file. | data_image0
_chemical_formula_structural MgAg14Pb6O18
_chemical_formula_sum "Mg1 Ag14 Pb6 O18"
_cell_length_a 9.08901966
_cell_length_b 8.95184834
_cell_length_c 8.79319796
_cell_angle_alpha 72.02934903
_cell_angle_beta 106.18165753
_cell_angle_gamma 106.745119
_space_gro... | data_image0
_chemical_formula_structural MgAg6Pb2O10
_chemical_formula_sum "Mg1 Ag6 Pb2 O10"
_cell_length_a 9.08901966
_cell_length_b 8.95184834
_cell_length_c 8.79319796
_cell_angle_alpha 72.02934903
_cell_angle_beta 106.18165753
_cell_angle_gamma 106.745119
_space_group... |
DeleteAroundAtomAction | fe1f4d81-cb42-4103-a8f1-f05d40c40e93 | mp-757738 | Delete all atoms within 2.89 angstrom around the atom at index 23 in the cif file. | data_image0
_chemical_formula_structural Fe19Co5O32
_chemical_formula_sum "Fe19 Co5 O32"
_cell_length_a 8.52149173
_cell_length_b 8.521491729999997
_cell_length_c 10.391043419999999
_cell_angle_alpha 66.16597597
_cell_angle_beta 66.16597596999999
_cell_angle_gamma 89.91677... | data_image0
_chemical_formula_structural Fe19Co4O26
_chemical_formula_sum "Fe19 Co4 O26"
_cell_length_a 8.52149173
_cell_length_b 8.521491729999997
_cell_length_c 10.391043419999999
_cell_angle_alpha 66.16597597
_cell_angle_beta 66.16597596999999
_cell_angle_gamma 89.91677... |
DeleteAroundAtomAction | 3e39bf85-4fd4-433d-8fdf-ab2b655e89b6 | mp-1223619 | Delete all atoms within 2.703 angstrom around the atom at index 24 in the cif file. | data_image0
_chemical_formula_structural Mg4Al4Si16O60
_chemical_formula_sum "Mg4 Al4 Si16 O60"
_cell_length_a 5.36580177
_cell_length_b 12.84649751
_cell_length_c 18.23494156
_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 Mg3Al3Si15O56
_chemical_formula_sum "Mg3 Al3 Si15 O56"
_cell_length_a 5.36580177
_cell_length_b 12.84649751
_cell_length_c 18.23494156
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | c8cd70c0-ecc4-481a-b755-a393191c126f | mp-23451 | Delete all atoms within 2.811 angstrom around the atom at index 18 in the cif file. | data_image0
_chemical_formula_structural Cs6Cr4Br18
_chemical_formula_sum "Cs6 Cr4 Br18"
_cell_length_a 7.62323495
_cell_length_b 7.62327647
_cell_length_c 19.0983966
_cell_angle_alpha 90.00298197
_cell_angle_beta 89.99842621
_cell_angle_gamma 119.99949748000002
_space_gr... | data_image0
_chemical_formula_structural Cs6Cr2Br17
_chemical_formula_sum "Cs6 Cr2 Br17"
_cell_length_a 7.62323495
_cell_length_b 7.62327647
_cell_length_c 19.0983966
_cell_angle_alpha 90.00298197
_cell_angle_beta 89.99842621
_cell_angle_gamma 119.99949748000002
_space_gr... |
DeleteAroundAtomAction | 206f038a-38dd-4f6d-9bd1-fe3479982d51 | mp-1212741 | Delete all atoms within 3.262 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural Eu2Al6B8O24
_chemical_formula_sum "Eu2 Al6 B8 O24"
_cell_length_a 5.96691806
_cell_length_b 5.96691806
_cell_length_c 11.285481099999998
_cell_angle_alpha 81.50343243
_cell_angle_beta 81.50343243
_cell_angle_gamma 104.10647599
_spa... | data_image0
_chemical_formula_structural Eu2Al3B4O18
_chemical_formula_sum "Eu2 Al3 B4 O18"
_cell_length_a 5.96691806
_cell_length_b 5.96691806
_cell_length_c 11.285481099999998
_cell_angle_alpha 81.50343243
_cell_angle_beta 81.50343243
_cell_angle_gamma 104.10647599
_spa... |
DeleteAroundAtomAction | f6e87d05-092a-4f97-bbbc-9d13b99c0b82 | mp-1247150 | Delete all atoms within 3.424 angstrom around the atom at index 49 in the cif file. | data_image0
_chemical_formula_structural Li4Mn24N28
_chemical_formula_sum "Li4 Mn24 N28"
_cell_length_a 13.00233388
_cell_length_b 5.65481
_cell_length_c 7.95383811
_cell_angle_alpha 90.0
_cell_angle_beta 82.02367282
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural Li3Mn20N19
_chemical_formula_sum "Li3 Mn20 N19"
_cell_length_a 13.00233388
_cell_length_b 5.65481
_cell_length_c 7.95383811
_cell_angle_alpha 90.0
_cell_angle_beta 82.02367282
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P ... |
DeleteAroundAtomAction | a1c186ea-bbe2-450f-ac5c-34cf9f7fc227 | mp-861587 | Delete all atoms within 3.873 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural Pr2In8Pd
_chemical_formula_sum "Pr2 In8 Pd1"
_cell_length_a 4.71906071
_cell_length_b 4.71904568
_cell_length_c 12.291611279999998
_cell_angle_alpha 89.99592426
_cell_angle_beta 90.00111952000002
_cell_angle_gamma 90.01682849
_spac... | data_image0
_chemical_formula_structural PrIn3Pd
_chemical_formula_sum "Pr1 In3 Pd1"
_cell_length_a 4.71906071
_cell_length_b 4.71904568
_cell_length_c 12.291611279999998
_cell_angle_alpha 89.99592426
_cell_angle_beta 90.00111952000002
_cell_angle_gamma 90.01682849
_space... |
DeleteAroundAtomAction | ed3ccc4e-a743-4783-9ac1-a8f8945328b8 | mp-1224899 | Delete all atoms within 3.488 angstrom around the atom at index 3 in the cif file. | data_image0
_chemical_formula_structural FeRePb2O6
_chemical_formula_sum "Fe1 Re1 Pb2 O6"
_cell_length_a 5.68562389
_cell_length_b 5.6856238900000005
_cell_length_c 5.68562389
_cell_angle_alpha 119.92988942
_cell_angle_beta 119.92988942
_cell_angle_gamma 90.12147804
_spac... | data_image0
_chemical_formula_structural Pb
_chemical_formula_sum "Pb1"
_cell_length_a 5.68562389
_cell_length_b 5.6856238900000005
_cell_length_c 5.68562389
_cell_angle_alpha 119.92988942
_cell_angle_beta 119.92988942
_cell_angle_gamma 90.12147804
_space_group_name_H-M_a... |
DeleteAroundAtomAction | 7c01c071-b58c-4c9b-b331-0e298c7e6cc1 | mp-1214585 | Delete all atoms within 3.663 angstrom around the atom at index 1 in the cif file. | data_image0
_chemical_formula_structural Ba2PrCu3O6
_chemical_formula_sum "Ba2 Pr1 Cu3 O6"
_cell_length_a 3.927893
_cell_length_b 3.927893
_cell_length_c 12.23912
_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 BaPrCuO3
_chemical_formula_sum "Ba1 Pr1 Cu1 O3"
_cell_length_a 3.927893
_cell_length_b 3.927893
_cell_length_c 12.23912
_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... |
DeleteAroundAtomAction | a19b0f2a-61ef-459b-b657-2c50f2a4e2a0 | mp-557123 | Delete all atoms within 1.896 angstrom around the atom at index 32 in the cif file. | data_image0
_chemical_formula_structural Na8Cu4Si12O32
_chemical_formula_sum "Na8 Cu4 Si12 O32"
_cell_length_a 10.410557
_cell_length_b 8.012812
_cell_length_c 9.73027488
_cell_angle_alpha 74.34396582
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Na8Cu4Si10O31
_chemical_formula_sum "Na8 Cu4 Si10 O31"
_cell_length_a 10.410557
_cell_length_b 8.012812
_cell_length_c 9.73027488
_cell_angle_alpha 74.34396582
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | 2aae9da1-6a16-4e6f-ba6a-48c28cfb38e6 | mp-29185 | Delete all atoms within 3.047 angstrom around the atom at index 12 in the cif file. | data_image0
_chemical_formula_structural Te4O6F4
_chemical_formula_sum "Te4 O6 F4"
_cell_length_a 5.14559993
_cell_length_b 6.25064884
_cell_length_c 6.88325924
_cell_angle_alpha 98.52769727000002
_cell_angle_beta 110.22595476999999
_cell_angle_gamma 92.67831409999998
_sp... | data_image0
_chemical_formula_structural O3
_chemical_formula_sum "O3"
_cell_length_a 5.14559993
_cell_length_b 6.25064884
_cell_length_c 6.88325924
_cell_angle_alpha 98.52769727000002
_cell_angle_beta 110.22595476999999
_cell_angle_gamma 92.67831409999998
_space_group_na... |
DeleteAroundAtomAction | c63c3dce-e6d1-4e7d-b4d1-87248c41aa75 | mp-532424 | Delete all atoms within 2.842 angstrom around the atom at index 22 in the cif file. | data_image0
_chemical_formula_structural K2Al22O34
_chemical_formula_sum "K2 Al22 O34"
_cell_length_a 5.64933404
_cell_length_b 5.64933404
_cell_length_c 23.20832425
_cell_angle_alpha 83.2237268
_cell_angle_beta 83.2237268
_cell_angle_gamma 60.13413613
_space_group_name_H... | data_image0
_chemical_formula_structural K2Al19O28
_chemical_formula_sum "K2 Al19 O28"
_cell_length_a 5.64933404
_cell_length_b 5.64933404
_cell_length_c 23.20832425
_cell_angle_alpha 83.2237268
_cell_angle_beta 83.2237268
_cell_angle_gamma 60.13413613
_space_group_name_H... |
DeleteAroundAtomAction | d0b7c5e6-c8ba-4f4c-ab79-85efbf83e6ea | mp-976118 | Delete all atoms within 3.25 angstrom around the atom at index 21 in the cif file. | data_image0
_chemical_formula_structural Hg2H12I6N2O2
_chemical_formula_sum "Hg2 H12 I6 N2 O2"
_cell_length_a 7.38594597
_cell_length_b 7.38594597
_cell_length_c 9.046789620000002
_cell_angle_alpha 88.57508227
_cell_angle_beta 88.57508227
_cell_angle_gamma 81.43844644
_sp... | data_image0
_chemical_formula_structural Hg2H5I6N
_chemical_formula_sum "Hg2 H5 I6 N1"
_cell_length_a 7.38594597
_cell_length_b 7.38594597
_cell_length_c 9.046789620000002
_cell_angle_alpha 88.57508227
_cell_angle_beta 88.57508227
_cell_angle_gamma 81.43844644
_space_grou... |
DeleteAroundAtomAction | 4a9924e5-62a7-4bc5-9b3c-2bc7ce104f6c | mp-1218673 | Delete all atoms within 3.453 angstrom around the atom at index 7 in the cif file. | data_image0
_chemical_formula_structural Sr4Zn51
_chemical_formula_sum "Sr4 Zn51"
_cell_length_a 14.96096755
_cell_length_b 14.960967550000001
_cell_length_c 14.960967560000002
_cell_angle_alpha 33.90467868000001
_cell_angle_beta 33.90467868000001
_cell_angle_gamma 33.9046... | data_image0
_chemical_formula_structural Sr4Zn40
_chemical_formula_sum "Sr4 Zn40"
_cell_length_a 14.96096755
_cell_length_b 14.960967550000001
_cell_length_c 14.960967560000002
_cell_angle_alpha 33.90467868000001
_cell_angle_beta 33.90467868000001
_cell_angle_gamma 33.9046... |
DeleteAroundAtomAction | 992f0f9d-1286-4dff-bc75-baee3dc1d7ec | mp-1189919 | Delete all atoms within 3.483 angstrom around the atom at index 1 in the cif file. | data_image0
_chemical_formula_structural Li3P3O12
_chemical_formula_sum "Li3 P3 O12"
_cell_length_a 7.48802157
_cell_length_b 7.48802157
_cell_length_c 7.488021340000001
_cell_angle_alpha 114.25624954000001
_cell_angle_beta 114.25624954
_cell_angle_gamma 114.25623792
_spa... | data_image0
_chemical_formula_structural PO6
_chemical_formula_sum "P1 O6"
_cell_length_a 7.48802157
_cell_length_b 7.48802157
_cell_length_c 7.488021340000001
_cell_angle_alpha 114.25624954000001
_cell_angle_beta 114.25624954
_cell_angle_gamma 114.25623792
_space_group_n... |
DeleteAroundAtomAction | 0f496e72-251a-4ea6-b0cb-89d6b4efa973 | mp-558681 | Delete all atoms within 3.506 angstrom around the atom at index 38 in the cif file. | data_image0
_chemical_formula_structural P8Cl8O8F16
_chemical_formula_sum "P8 Cl8 O8 F16"
_cell_length_a 5.55295745
_cell_length_b 9.90794988
_cell_length_c 13.09894283
_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 P7Cl7O6F11
_chemical_formula_sum "P7 Cl7 O6 F11"
_cell_length_a 5.55295745
_cell_length_b 9.90794988
_cell_length_c 13.09894283
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
... |
DeleteAroundAtomAction | e890ce4f-dc4f-486c-ad13-341445542fb3 | mp-542012 | Delete all atoms within 2.651 angstrom around the atom at index 34 in the cif file. | 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 Rb8Hf5S26
_chemical_formula_sum "Rb8 Hf5 S26"
_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... |
DeleteAroundAtomAction | 2123a84a-794a-4bda-b813-d74450a007a6 | mp-19489 | Delete all atoms within 2.49 angstrom around the atom at index 12 in the cif file. | 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 Sm4Co4B18O37
_chemical_formula_sum "Sm4 Co4 B18 O37"
_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_... |
DeleteAroundAtomAction | 83181189-9653-4582-a872-6b33c806235d | mp-24402 | Delete all atoms within 3.235 angstrom around the atom at index 18 in the cif file. | data_image0
_chemical_formula_structural Ca4Al4Si4H4O20
_chemical_formula_sum "Ca4 Al4 Si4 H4 O20"
_cell_length_a 5.751519
_cell_length_b 7.119977
_cell_length_c 8.605031
_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 Ca3Al2Si3H3O10
_chemical_formula_sum "Ca3 Al2 Si3 H3 O10"
_cell_length_a 5.751519
_cell_length_b 7.119977
_cell_length_c 8.605031
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... |
DeleteAroundAtomAction | 464e8d56-7979-434e-ae4f-7bf9c3e15e79 | mp-861061 | Delete all atoms within 3.297 angstrom around the atom at index 13 in the cif file. | data_image0
_chemical_formula_structural Li4Si6Ni6O20
_chemical_formula_sum "Li4 Si6 Ni6 O20"
_cell_length_a 8.18177174
_cell_length_b 8.18177174
_cell_length_c 10.22695143
_cell_angle_alpha 86.90636598
_cell_angle_beta 86.90636598
_cell_angle_gamma 33.921792270000005
_sp... | data_image0
_chemical_formula_structural Li2Si4Ni3O14
_chemical_formula_sum "Li2 Si4 Ni3 O14"
_cell_length_a 8.18177174
_cell_length_b 8.18177174
_cell_length_c 10.22695143
_cell_angle_alpha 86.90636598
_cell_angle_beta 86.90636598
_cell_angle_gamma 33.921792270000005
_sp... |
DeleteAroundAtomAction | f5cafca2-f3d0-44c5-8ee1-17af4561787e | mp-572465 | Delete all atoms within 3.53 angstrom around the atom at index 5 in the cif file. | data_image0
_chemical_formula_structural Cr4Cu4P8S24
_chemical_formula_sum "Cr4 Cu4 P8 S24"
_cell_length_a 10.378013
_cell_length_b 5.985366
_cell_length_c 14.53043325
_cell_angle_alpha 74.92798852
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Cr4Cu3P6S21
_chemical_formula_sum "Cr4 Cu3 P6 S21"
_cell_length_a 10.378013
_cell_length_b 5.985366
_cell_length_c 14.53043325
_cell_angle_alpha 74.92798852
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | 9b3bcd09-9bf0-4d8c-a8de-72724c09b7a6 | mp-1044027 | Delete all atoms within 2.937 angstrom around the atom at index 3 in the cif file. | data_image0
_chemical_formula_structural Ca2La2Fe2W2O12
_chemical_formula_sum "Ca2 La2 Fe2 W2 O12"
_cell_length_a 5.64050216
_cell_length_b 8.00577387
_cell_length_c 5.75555461
_cell_angle_alpha 89.84650841
_cell_angle_beta 90.76807382999999
_cell_angle_gamma 89.4459353
_... | data_image0
_chemical_formula_structural Ca2LaFe2W2O5
_chemical_formula_sum "Ca2 La1 Fe2 W2 O5"
_cell_length_a 5.64050216
_cell_length_b 8.00577387
_cell_length_c 5.75555461
_cell_angle_alpha 89.84650841
_cell_angle_beta 90.76807382999999
_cell_angle_gamma 89.4459353
_spa... |
DeleteAroundAtomAction | cfd9e53b-791d-4d74-a23b-cedd2bc4b59e | mp-1111119 | Delete all atoms within 2.503 angstrom around the atom at index 6 in the cif file. | data_image0
_chemical_formula_structural K2YInF6
_chemical_formula_sum "K2 Y1 In1 F6"
_cell_length_a 6.75247661
_cell_length_b 6.752476610000001
_cell_length_c 6.75247661
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.9999999999... | data_image0
_chemical_formula_structural K2InF5
_chemical_formula_sum "K2 In1 F5"
_cell_length_a 6.75247661
_cell_length_b 6.752476610000001
_cell_length_c 6.75247661
_cell_angle_alpha 59.99999999999999
_cell_angle_beta 59.99999999999999
_cell_angle_gamma 59.99999999999999... |
DeleteAroundAtomAction | 35ff37a1-a2d6-4e42-8352-9c79e496e8f0 | mp-1043709 | Delete all atoms within 3.403 angstrom around the atom at index 4 in the cif file. | data_image0
_chemical_formula_structural Ca2Ti2Sn2P6O24
_chemical_formula_sum "Ca2 Ti2 Sn2 P6 O24"
_cell_length_a 8.98097891
_cell_length_b 8.9809792
_cell_length_c 8.98097933
_cell_angle_alpha 58.52300131
_cell_angle_beta 58.523004359999995
_cell_angle_gamma 58.5230127799... | data_image0
_chemical_formula_structural CaTi2SnP6O18
_chemical_formula_sum "Ca1 Ti2 Sn1 P6 O18"
_cell_length_a 8.98097891
_cell_length_b 8.9809792
_cell_length_c 8.98097933
_cell_angle_alpha 58.52300131
_cell_angle_beta 58.523004359999995
_cell_angle_gamma 58.523012779999... |
DeleteAroundAtomAction | d5f5c128-2f80-4674-bbad-adaef1a22c85 | mp-779533 | Delete all atoms within 3.008 angstrom around the atom at index 5 in the cif file. | data_image0
_chemical_formula_structural Ba12Br8O8
_chemical_formula_sum "Ba12 Br8 O8"
_cell_length_a 6.367137
_cell_length_b 7.584598
_cell_length_c 19.738796
_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 Ba11Br8O4
_chemical_formula_sum "Ba11 Br8 O4"
_cell_length_a 6.367137
_cell_length_b 7.584598
_cell_length_c 19.738796
_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... |
DeleteAroundAtomAction | 310ebb20-0959-47b2-8328-c9e374d54f56 | mp-1227442 | Delete all atoms within 3.481 angstrom around the atom at index 10 in the cif file. | data_image0
_chemical_formula_structural Be2BH3O5
_chemical_formula_sum "Be2 B1 H3 O5"
_cell_length_a 4.41713532
_cell_length_b 4.43574167
_cell_length_c 5.27555646
_cell_angle_alpha 92.43461318
_cell_angle_beta 89.13916789
_cell_angle_gamma 119.89439418000002
_space_grou... | data_image0
_chemical_formula_structural Be
_chemical_formula_sum "Be1"
_cell_length_a 4.41713532
_cell_length_b 4.43574167
_cell_length_c 5.27555646
_cell_angle_alpha 92.43461318
_cell_angle_beta 89.13916789
_cell_angle_gamma 119.89439418000002
_space_group_name_H-M_alt ... |
DeleteAroundAtomAction | d0c3f256-691b-46f7-9cad-96b9afbc529b | mp-28481 | Delete all atoms within 2.69 angstrom around the atom at index 29 in the cif file. | data_image0
_chemical_formula_structural Ti2Cl8O32
_chemical_formula_sum "Ti2 Cl8 O32"
_cell_length_a 7.36965456
_cell_length_b 7.36959662
_cell_length_c 12.98710817
_cell_angle_alpha 73.70079455
_cell_angle_beta 73.7011985
_cell_angle_gamma 64.01522777
_space_group_name_... | data_image0
_chemical_formula_structural TiCl7O27
_chemical_formula_sum "Ti1 Cl7 O27"
_cell_length_a 7.36965456
_cell_length_b 7.36959662
_cell_length_c 12.98710817
_cell_angle_alpha 73.70079455
_cell_angle_beta 73.7011985
_cell_angle_gamma 64.01522777
_space_group_name_H... |
DeleteAroundAtomAction | c4d1d956-44ee-4774-bed9-1fc63dc75739 | mp-1199329 | Delete all atoms within 3.029 angstrom around the atom at index 21 in the cif file. | data_image0
_chemical_formula_structural Gd4P4H4C8O24
_chemical_formula_sum "Gd4 P4 H4 C8 O24"
_cell_length_a 8.2001204
_cell_length_b 9.48457093
_cell_length_c 9.48457093
_cell_angle_alpha 65.00064109
_cell_angle_beta 77.6201021
_cell_angle_gamma 77.6201021
_space_group_... | data_image0
_chemical_formula_structural Gd2P3H3C8O16
_chemical_formula_sum "Gd2 P3 H3 C8 O16"
_cell_length_a 8.2001204
_cell_length_b 9.48457093
_cell_length_c 9.48457093
_cell_angle_alpha 65.00064109
_cell_angle_beta 77.6201021
_cell_angle_gamma 77.6201021
_space_group_... |
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