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 | e0efea70-776f-44b8-ab32-03ea48399998 | mp-1224332 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural InAs4Pd15
_chemical_formula_sum "In1 As4 Pd15"
_cell_length_a 18.47709191
_cell_length_b 18.47709191
_cell_length_c 18.47709221
_cell_angle_alpha 13.853155029999996
_cell_angle_beta 13.853155029999996
_cell_angle_gamma 13.8531551699... | data_image0
_chemical_formula_structural InAs4Pd14
_chemical_formula_sum "In1 As4 Pd14"
_cell_length_a 18.47709191
_cell_length_b 18.47709191
_cell_length_c 18.47709221
_cell_angle_alpha 13.853155029999996
_cell_angle_beta 13.853155029999996
_cell_angle_gamma 13.8531551699... |
RemoveAtomAction | b0458b21-6662-41f0-b143-bdf3b44b5208 | mp-1026902 | Remove the atom at index 14 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg14CuB
_chemical_formula_sum "Mg14 Cu1 B1"
_cell_length_a 6.21930327
_cell_length_b 6.273270720000001
_cell_length_c 9.98555831
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.28746915
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Mg14B
_chemical_formula_sum "Mg14 B1"
_cell_length_a 6.21930327
_cell_length_b 6.273270720000001
_cell_length_c 9.98555831
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.28746915
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | 2c9daf7f-9f36-4295-9f53-b6a0e05b5e64 | mp-1228475 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba10Mn2Co8O28
_chemical_formula_sum "Ba10 Mn2 Co8 O28"
_cell_length_a 5.789929
_cell_length_b 10.016607
_cell_length_c 12.0896831
_cell_angle_alpha 89.94737559
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Ba9Mn2Co8O28
_chemical_formula_sum "Ba9 Mn2 Co8 O28"
_cell_length_a 5.789929
_cell_length_b 10.016607
_cell_length_c 12.0896831
_cell_angle_alpha 89.94737559
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | e525f339-b405-4767-bcb9-bf1b8452b8f7 | mp-1195795 | Remove the atom at index 16 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural La4Y11S22
_chemical_formula_sum "La4 Y11 S22"
_cell_length_a 19.85295513
_cell_length_b 19.85295513
_cell_length_c 11.44709179
_cell_angle_alpha 88.44478713
_cell_angle_beta 88.44478713
_cell_angle_gamma 11.543549940000046
_space_g... | data_image0
_chemical_formula_structural La4Y11S21
_chemical_formula_sum "La4 Y11 S21"
_cell_length_a 19.85295513
_cell_length_b 19.85295513
_cell_length_c 11.44709179
_cell_angle_alpha 88.44478713
_cell_angle_beta 88.44478713
_cell_angle_gamma 11.543549940000046
_space_g... |
RemoveAtomAction | ac2931d3-48d7-41d0-a706-e0ae98b81d44 | mp-2219699 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K2MgRe2O8
_chemical_formula_sum "K2 Mg1 Re2 O8"
_cell_length_a 5.54549561
_cell_length_b 6.37898571
_cell_length_c 7.9827836
_cell_angle_alpha 113.78128377
_cell_angle_beta 110.25819822000001
_cell_angle_gamma 90.07065235
_space_gr... | data_image0
_chemical_formula_structural K2MgRe2O7
_chemical_formula_sum "K2 Mg1 Re2 O7"
_cell_length_a 5.54549561
_cell_length_b 6.37898571
_cell_length_c 7.9827836
_cell_angle_alpha 113.78128377
_cell_angle_beta 110.25819822000001
_cell_angle_gamma 90.07065235
_space_gr... |
RemoveAtomAction | 32ff5cf4-bffa-4a71-aff3-316286d6d587 | mp-667336 | Remove the atom at index 21 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cs16Zr12Te64
_chemical_formula_sum "Cs16 Zr12 Te64"
_cell_length_a 19.784849
_cell_length_b 12.217208
_cell_length_c 17.97604476
_cell_angle_alpha 60.070154949999996
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-... | data_image0
_chemical_formula_structural Cs16Zr11Te64
_chemical_formula_sum "Cs16 Zr11 Te64"
_cell_length_a 19.784849
_cell_length_b 12.217208
_cell_length_c 17.97604476
_cell_angle_alpha 60.070154949999996
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-... |
RemoveAtomAction | 2493448e-bff5-431e-baec-f080412119af | mp-1209541 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Se3N3O12
_chemical_formula_sum "Se3 N3 O12"
_cell_length_a 9.26032011
_cell_length_b 9.26032011
_cell_length_c 5.68882602
_cell_angle_alpha 82.87290882000002
_cell_angle_beta 82.87290882000002
_cell_angle_gamma 53.16993631
_space_g... | data_image0
_chemical_formula_structural Se3N3O11
_chemical_formula_sum "Se3 N3 O11"
_cell_length_a 9.26032011
_cell_length_b 9.26032011
_cell_length_c 5.68882602
_cell_angle_alpha 82.87290882000002
_cell_angle_beta 82.87290882000002
_cell_angle_gamma 53.16993631
_space_g... |
RemoveAtomAction | 493d69b8-8eca-4016-b311-106cd9a3230d | mp-1217947 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | 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 Ta4Nb4Ag7O24
_chemical_formula_sum "Ta4 Nb4 Ag7 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... |
RemoveAtomAction | 40972157-71c4-4a85-ad20-7d039558a7a7 | mp-675510 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural As8Pd10Pb2
_chemical_formula_sum "As8 Pd10 Pb2"
_cell_length_a 19.72310211
_cell_length_b 6.816069789999999
_cell_length_c 6.88341192
_cell_angle_alpha 60.10400328000001
_cell_angle_beta 55.62289422
_cell_angle_gamma 29.595271559999... | data_image0
_chemical_formula_structural As7Pd10Pb2
_chemical_formula_sum "As7 Pd10 Pb2"
_cell_length_a 19.72310211
_cell_length_b 6.816069789999999
_cell_length_c 6.88341192
_cell_angle_alpha 60.10400328000001
_cell_angle_beta 55.62289422
_cell_angle_gamma 29.595271559999... |
RemoveAtomAction | 0f2f4de2-a95d-460e-a859-64bde7b51d17 | mp-1035887 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KMg14WO16
_chemical_formula_sum "K1 Mg14 W1 O16"
_cell_length_a 4.394113
_cell_length_b 8.642247
_cell_length_c 8.787907
_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 KMg14WO15
_chemical_formula_sum "K1 Mg14 W1 O15"
_cell_length_a 4.394113
_cell_length_b 8.642247
_cell_length_c 8.787907
_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 | 2a7d32ec-df57-49a7-b55a-ff9c3818b075 | mp-510 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ta16O32
_chemical_formula_sum "Ta16 O32"
_cell_length_a 10.22760131
_cell_length_b 10.22760131
_cell_length_c 10.22760131
_cell_angle_alpha 94.97482101
_cell_angle_beta 94.97482101
_cell_angle_gamma 145.74738884999996
_space_group_... | data_image0
_chemical_formula_structural Ta15O32
_chemical_formula_sum "Ta15 O32"
_cell_length_a 10.22760131
_cell_length_b 10.22760131
_cell_length_c 10.22760131
_cell_angle_alpha 94.97482101
_cell_angle_beta 94.97482101
_cell_angle_gamma 145.74738884999996
_space_group_... |
RemoveAtomAction | 0d755429-93ff-4648-8c58-47ca081b5bcf | mp-754770 | Remove the atom at index 17 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Mn4F12
_chemical_formula_sum "Li4 Mn4 F12"
_cell_length_a 10.224994
_cell_length_b 3.803119
_cell_length_c 6.94525512
_cell_angle_alpha 87.3230362
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... | data_image0
_chemical_formula_structural Li4Mn4F11
_chemical_formula_sum "Li4 Mn4 F11"
_cell_length_a 10.224994
_cell_length_b 3.803119
_cell_length_c 6.94525512
_cell_angle_alpha 87.3230362
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RemoveAtomAction | a8691adc-8947-489e-9b0d-adfb88abc793 | mp-1201159 | Remove the atom at index 37 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na4Mn2H8Se4O20
_chemical_formula_sum "Na4 Mn2 H8 Se4 O20"
_cell_length_a 5.7906892
_cell_length_b 6.02711618
_cell_length_c 13.704505
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 105.82983314
_space_group_name_H-M... | data_image0
_chemical_formula_structural Na4Mn2H8Se4O19
_chemical_formula_sum "Na4 Mn2 H8 Se4 O19"
_cell_length_a 5.7906892
_cell_length_b 6.02711618
_cell_length_c 13.704505
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 105.82983314
_space_group_name_H-M... |
RemoveAtomAction | 0acfa970-f776-4041-bc9c-81466d8bc225 | mp-753610 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba2Ca2I8
_chemical_formula_sum "Ba2 Ca2 I8"
_cell_length_a 11.45684617
_cell_length_b 11.45684617
_cell_length_c 8.300787
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 149.20882434999996
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Ba2Ca2I7
_chemical_formula_sum "Ba2 Ca2 I7"
_cell_length_a 11.45684617
_cell_length_b 11.45684617
_cell_length_c 8.300787
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 149.20882434999996
_space_group_name_H-M_alt ... |
RemoveAtomAction | 698276da-6a9d-45e4-b396-e86b0987b717 | mp-753686 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4V2Cr2P4O16F4
_chemical_formula_sum "Li4 V2 Cr2 P4 O16 F4"
_cell_length_a 5.37201066
_cell_length_b 10.2257436
_cell_length_c 7.3471609
_cell_angle_alpha 76.01483243999999
_cell_angle_beta 73.07426687
_cell_angle_gamma 99.89994098... | data_image0
_chemical_formula_structural Li4V2Cr2P3O16F4
_chemical_formula_sum "Li4 V2 Cr2 P3 O16 F4"
_cell_length_a 5.37201066
_cell_length_b 10.2257436
_cell_length_c 7.3471609
_cell_angle_alpha 76.01483243999999
_cell_angle_beta 73.07426687
_cell_angle_gamma 99.89994098... |
RemoveAtomAction | 178197d7-6edf-42b6-b5f6-074021eff158 | mp-695175 | Remove the atom at index 61 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na3Sr14Nd3Ti20O60
_chemical_formula_sum "Na3 Sr14 Nd3 Ti20 O60"
_cell_length_a 5.53353707
_cell_length_b 5.533537070000001
_cell_length_c 39.484861
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.02449801
_space_g... | data_image0
_chemical_formula_structural Na3Sr14Nd3Ti20O59
_chemical_formula_sum "Na3 Sr14 Nd3 Ti20 O59"
_cell_length_a 5.53353707
_cell_length_b 5.533537070000001
_cell_length_c 39.484861
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.02449801
_space_g... |
RemoveAtomAction | e9fdd154-d6c1-44b9-b42c-0389c395402e | mp-1442904 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca2Cu2F10
_chemical_formula_sum "Ca2 Cu2 F10"
_cell_length_a 5.544288
_cell_length_b 5.55540198
_cell_length_c 7.71083208
_cell_angle_alpha 69.38132926
_cell_angle_beta 69.63660232
_cell_angle_gamma 71.15789169
_space_group_name_H-... | data_image0
_chemical_formula_structural Ca2Cu2F9
_chemical_formula_sum "Ca2 Cu2 F9"
_cell_length_a 5.544288
_cell_length_b 5.55540198
_cell_length_c 7.71083208
_cell_angle_alpha 69.38132926
_cell_angle_beta 69.63660232
_cell_angle_gamma 71.15789169
_space_group_name_H-M_... |
RemoveAtomAction | 11034b29-d9d4-4d1c-9a9b-2330aa13ed08 | mp-1072993 | Remove the atom at index 14 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg8Si12
_chemical_formula_sum "Mg8 Si12"
_cell_length_a 5.42959707
_cell_length_b 5.429597070000001
_cell_length_c 18.53523443
_cell_angle_alpha 80.42024984999999
_cell_angle_beta 80.42024984999999
_cell_angle_gamma 41.3923071800000... | data_image0
_chemical_formula_structural Mg8Si11
_chemical_formula_sum "Mg8 Si11"
_cell_length_a 5.42959707
_cell_length_b 5.429597070000001
_cell_length_c 18.53523443
_cell_angle_alpha 80.42024984999999
_cell_angle_beta 80.42024984999999
_cell_angle_gamma 41.3923071800000... |
RemoveAtomAction | 08bf9dee-7966-4abe-9792-97511fd809be | mp-531661 | Remove the atom at index 23 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Nd10Ti12O39
_chemical_formula_sum "Nd10 Ti12 O39"
_cell_length_a 7.273009
_cell_length_b 10.2912685
_cell_length_c 12.53064596
_cell_angle_alpha 113.59612546
_cell_angle_beta 106.80972901999999
_cell_angle_gamma 88.92613835
_space_... | data_image0
_chemical_formula_structural Nd10Ti12O38
_chemical_formula_sum "Nd10 Ti12 O38"
_cell_length_a 7.273009
_cell_length_b 10.2912685
_cell_length_c 12.53064596
_cell_angle_alpha 113.59612546
_cell_angle_beta 106.80972901999999
_cell_angle_gamma 88.92613835
_space_... |
RemoveAtomAction | a207b747-75d7-4e3e-af66-9a611b672629 | mp-1209763 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rb8Eu4F20
_chemical_formula_sum "Rb8 Eu4 F20"
_cell_length_a 7.019993
_cell_length_b 7.75779
_cell_length_c 11.718263
_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 Rb7Eu4F20
_chemical_formula_sum "Rb7 Eu4 F20"
_cell_length_a 7.019993
_cell_length_b 7.75779
_cell_length_c 11.718263
_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... |
RemoveAtomAction | 923dd42f-b0a5-42e9-b331-2890d663a8c3 | mp-618177 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K8Zn4Cl16
_chemical_formula_sum "K8 Zn4 Cl16"
_cell_length_a 7.1589231
_cell_length_b 8.87527911
_cell_length_c 12.57361805
_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 K8Zn3Cl16
_chemical_formula_sum "K8 Zn3 Cl16"
_cell_length_a 7.1589231
_cell_length_b 8.87527911
_cell_length_c 12.57361805
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RemoveAtomAction | 135a1529-95d6-451a-93bb-812712edb6de | mp-1217947 | Remove the atom at index 25 from the cif file. The indices of atoms are started from 0. | 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 Ta4Nb4Ag8O23
_chemical_formula_sum "Ta4 Nb4 Ag8 O23"
_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... |
RemoveAtomAction | 3f86156a-7e98-429c-9736-96a7433aad57 | mp-1033433 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural SrMg6NbO8
_chemical_formula_sum "Sr1 Mg6 Nb1 O8"
_cell_length_a 8.92237953
_cell_length_b 4.49102413
_cell_length_c 4.49102413
_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 SrMg5NbO8
_chemical_formula_sum "Sr1 Mg5 Nb1 O8"
_cell_length_a 8.92237953
_cell_length_b 4.49102413
_cell_length_c 4.49102413
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RemoveAtomAction | f322cd5d-1dcb-4539-b32f-e7526c43d236 | mp-1193262 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ce2Fe18Si8
_chemical_formula_sum "Ce2 Fe18 Si8"
_cell_length_a 7.791859
_cell_length_b 7.791859
_cell_length_c 7.97863255
_cell_angle_alpha 119.22859988999998
_cell_angle_beta 119.22859988999998
_cell_angle_gamma 90.0
_space_group_... | data_image0
_chemical_formula_structural Ce2Fe17Si8
_chemical_formula_sum "Ce2 Fe17 Si8"
_cell_length_a 7.791859
_cell_length_b 7.791859
_cell_length_c 7.97863255
_cell_angle_alpha 119.22859988999998
_cell_angle_beta 119.22859988999998
_cell_angle_gamma 90.0
_space_group_... |
RemoveAtomAction | 65e00fbd-8338-4a27-ae40-ff4e7bb9b0a0 | mp-1200661 | Remove the atom at index 48 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K4Na12In36
_chemical_formula_sum "K4 Na12 In36"
_cell_length_a 9.90093006
_cell_length_b 9.90093006
_cell_length_c 17.79098968
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 117.70560703999999
_space_group_name_H-M_... | data_image0
_chemical_formula_structural K4Na12In35
_chemical_formula_sum "K4 Na12 In35"
_cell_length_a 9.90093006
_cell_length_b 9.90093006
_cell_length_c 17.79098968
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 117.70560703999999
_space_group_name_H-M_... |
RemoveAtomAction | 662d65f0-a549-4400-9b9e-eb5d682c3115 | mp-23702 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4H8N4
_chemical_formula_sum "Li4 H8 N4"
_cell_length_a 4.93582519
_cell_length_b 4.93582403
_cell_length_c 6.17904506
_cell_angle_alpha 113.54069253
_cell_angle_beta 113.54068121000002
_cell_angle_gamma 89.99999577999999
_space_g... | data_image0
_chemical_formula_structural Li4H7N4
_chemical_formula_sum "Li4 H7 N4"
_cell_length_a 4.93582519
_cell_length_b 4.93582403
_cell_length_c 6.17904506
_cell_angle_alpha 113.54069253
_cell_angle_beta 113.54068121000002
_cell_angle_gamma 89.99999577999999
_space_g... |
RemoveAtomAction | 3614c76a-d870-4868-bdcb-52f235634385 | mp-1026931 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Te2Mo3WSe4S2
_chemical_formula_sum "Te2 Mo3 W1 Se4 S2"
_cell_length_a 3.34707973
_cell_length_b 3.34707973
_cell_length_c 38.097169
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999471999999
_space_group_name... | data_image0
_chemical_formula_structural Te2Mo3WSe3S2
_chemical_formula_sum "Te2 Mo3 W1 Se3 S2"
_cell_length_a 3.34707973
_cell_length_b 3.34707973
_cell_length_c 38.097169
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999471999999
_space_group_name... |
RemoveAtomAction | 86d179fb-3380-4d19-9fd1-f80281b17e05 | mp-2230054 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | 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 MgCu6OF10
_chemical_formula_sum "Mg1 Cu6 O1 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
_sp... |
RemoveAtomAction | e06dfd0b-3a82-41e5-b112-95c83f53c4c8 | mp-850249 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Fe8S10
_chemical_formula_sum "Fe8 S10"
_cell_length_a 7.85387303
_cell_length_b 7.85835612
_cell_length_c 10.20474771
_cell_angle_alpha 89.26431358
_cell_angle_beta 91.28775421000002
_cell_angle_gamma 90.00550234999999
_space_group... | data_image0
_chemical_formula_structural Fe8S9
_chemical_formula_sum "Fe8 S9"
_cell_length_a 7.85387303
_cell_length_b 7.85835612
_cell_length_c 10.20474771
_cell_angle_alpha 89.26431358
_cell_angle_beta 91.28775421000002
_cell_angle_gamma 90.00550234999999
_space_group_n... |
RemoveAtomAction | db8f2900-d4d2-45c1-90af-776c73a2eff0 | mp-1223914 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ho4ZrAl15
_chemical_formula_sum "Ho4 Zr1 Al15"
_cell_length_a 4.207757
_cell_length_b 4.207757
_cell_length_c 21.101916
_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 Ho3ZrAl15
_chemical_formula_sum "Ho3 Zr1 Al15"
_cell_length_a 4.207757
_cell_length_b 4.207757
_cell_length_c 21.101916
_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 | 86c2d6e5-e1e2-4b86-986b-06058048cac7 | mp-2231066 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K8MgTi2O8
_chemical_formula_sum "K8 Mg1 Ti2 O8"
_cell_length_a 8.18203921
_cell_length_b 8.18203921
_cell_length_c 6.64335206
_cell_angle_alpha 106.62125926
_cell_angle_beta 106.62125926
_cell_angle_gamma 79.53757545999999
_space_g... | data_image0
_chemical_formula_structural K8MgTiO8
_chemical_formula_sum "K8 Mg1 Ti1 O8"
_cell_length_a 8.18203921
_cell_length_b 8.18203921
_cell_length_c 6.64335206
_cell_angle_alpha 106.62125926
_cell_angle_beta 106.62125926
_cell_angle_gamma 79.53757545999999
_space_gr... |
RemoveAtomAction | 36968a3a-a2e3-48a1-8ccf-5b58a271837b | mp-42981 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na4Gd4Ti4Nb4O24F4
_chemical_formula_sum "Na4 Gd4 Ti4 Nb4 O24 F4"
_cell_length_a 7.355463
_cell_length_b 7.355463
_cell_length_c 10.410171
_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 Na4Gd4Ti4Nb4O23F4
_chemical_formula_sum "Na4 Gd4 Ti4 Nb4 O23 F4"
_cell_length_a 7.355463
_cell_length_b 7.355463
_cell_length_c 10.410171
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt... |
RemoveAtomAction | 162486e2-dccd-4194-8680-b7aff9c2d471 | mp-540876 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K2Th4P6O24
_chemical_formula_sum "K2 Th4 P6 O24"
_cell_length_a 9.56026706
_cell_length_b 9.560267059999997
_cell_length_c 8.233831920000002
_cell_angle_alpha 78.8105945
_cell_angle_beta 78.8105945
_cell_angle_gamma 42.36745654
_sp... | data_image0
_chemical_formula_structural K2Th3P6O24
_chemical_formula_sum "K2 Th3 P6 O24"
_cell_length_a 9.56026706
_cell_length_b 9.560267059999997
_cell_length_c 8.233831920000002
_cell_angle_alpha 78.8105945
_cell_angle_beta 78.8105945
_cell_angle_gamma 42.36745654
_sp... |
RemoveAtomAction | 030c6d9d-8fa1-4fec-9499-08cd83abceaa | mp-676305 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg8Sb4O18
_chemical_formula_sum "Mg8 Sb4 O18"
_cell_length_a 5.17879035
_cell_length_b 5.5631624
_cell_length_c 11.707019670000001
_cell_angle_alpha 98.16276452
_cell_angle_beta 102.73882857
_cell_angle_gamma 90.74375438
_space_gro... | data_image0
_chemical_formula_structural Mg8Sb3O18
_chemical_formula_sum "Mg8 Sb3 O18"
_cell_length_a 5.17879035
_cell_length_b 5.5631624
_cell_length_c 11.707019670000001
_cell_angle_alpha 98.16276452
_cell_angle_beta 102.73882857
_cell_angle_gamma 90.74375438
_space_gro... |
RemoveAtomAction | 97ed7a4b-9330-4886-a4be-53aa401d9695 | mp-695020 | Remove the atom at index 43 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na8Ga6Si6N2O28
_chemical_formula_sum "Na8 Ga6 Si6 N2 O28"
_cell_length_a 9.22651473
_cell_length_b 9.263441159999998
_cell_length_c 9.40644479
_cell_angle_alpha 89.69481915
_cell_angle_beta 90.06347053
_cell_angle_gamma 89.40421226
... | data_image0
_chemical_formula_structural Na8Ga6Si6N2O27
_chemical_formula_sum "Na8 Ga6 Si6 N2 O27"
_cell_length_a 9.22651473
_cell_length_b 9.263441159999998
_cell_length_c 9.40644479
_cell_angle_alpha 89.69481915
_cell_angle_beta 90.06347053
_cell_angle_gamma 89.40421226
... |
RemoveAtomAction | a4ba0dd5-e2e1-47cb-8928-3b3ce2f1be8d | mp-2215902 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgCu2Rh4O8
_chemical_formula_sum "Mg1 Cu2 Rh4 O8"
_cell_length_a 6.37190541
_cell_length_b 6.371854860000001
_cell_length_c 6.02917077
_cell_angle_alpha 90.05795307
_cell_angle_beta 118.18941429
_cell_angle_gamma 123.50880287
_spac... | data_image0
_chemical_formula_structural MgCu2Rh3O8
_chemical_formula_sum "Mg1 Cu2 Rh3 O8"
_cell_length_a 6.37190541
_cell_length_b 6.371854860000001
_cell_length_c 6.02917077
_cell_angle_alpha 90.05795307
_cell_angle_beta 118.18941429
_cell_angle_gamma 123.50880287
_spac... |
RemoveAtomAction | 78328cea-63b4-4d95-8532-e3e34ab0027a | mp-760927 | Remove the atom at index 21 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Na4Ti4P4O20
_chemical_formula_sum "Na4 Ti4 P4 O20"
_cell_length_a 6.547784
_cell_length_b 7.496283
_cell_length_c 7.817011
_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 Na4Ti4P4O19
_chemical_formula_sum "Na4 Ti4 P4 O19"
_cell_length_a 6.547784
_cell_length_b 7.496283
_cell_length_c 7.817011
_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 | a5b4fb6d-8b9e-463f-a731-4dfae81ad22e | mp-563048 | Remove the atom at index 21 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KFe3H6S2O14
_chemical_formula_sum "K1 Fe3 H6 S2 O14"
_cell_length_a 8.5991059
_cell_length_b 8.59910613
_cell_length_c 8.59910581
_cell_angle_alpha 66.12383906
_cell_angle_beta 66.12383544
_cell_angle_gamma 66.1238335
_space_group_... | data_image0
_chemical_formula_structural KFe3H6S2O13
_chemical_formula_sum "K1 Fe3 H6 S2 O13"
_cell_length_a 8.5991059
_cell_length_b 8.59910613
_cell_length_c 8.59910581
_cell_angle_alpha 66.12383906
_cell_angle_beta 66.12383544
_cell_angle_gamma 66.1238335
_space_group_... |
RemoveAtomAction | 56181b45-f591-44f6-8913-b1e4a7b43c72 | mp-1208067 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Tm16Cd4Pd4
_chemical_formula_sum "Tm16 Cd4 Pd4"
_cell_length_a 9.49881182
_cell_length_b 9.49868892
_cell_length_c 9.49875746
_cell_angle_alpha 59.99933265
_cell_angle_beta 59.99960467
_cell_angle_gamma 59.99946519
_space_group_nam... | data_image0
_chemical_formula_structural Tm15Cd4Pd4
_chemical_formula_sum "Tm15 Cd4 Pd4"
_cell_length_a 9.49881182
_cell_length_b 9.49868892
_cell_length_c 9.49875746
_cell_angle_alpha 59.99933265
_cell_angle_beta 59.99960467
_cell_angle_gamma 59.99946519
_space_group_nam... |
RemoveAtomAction | 34c43555-ea3c-454d-bcfe-f07d25841119 | mp-1020707 | Remove the atom at index 25 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rb8Ge4B16O36
_chemical_formula_sum "Rb8 Ge4 B16 O36"
_cell_length_a 10.066798
_cell_length_b 6.729355
_cell_length_c 13.46842072
_cell_angle_alpha 89.64486262
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Rb8Ge4B15O36
_chemical_formula_sum "Rb8 Ge4 B15 O36"
_cell_length_a 10.066798
_cell_length_b 6.729355
_cell_length_c 13.46842072
_cell_angle_alpha 89.64486262
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | eb3c5cdb-2987-45d3-9819-456e426f7d50 | mp-771389 | Remove the atom at index 18 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8V12Bi4O32
_chemical_formula_sum "Li8 V12 Bi4 O32"
_cell_length_a 8.71215
_cell_length_b 8.79877885
_cell_length_c 8.80335959
_cell_angle_alpha 89.98981681000001
_cell_angle_beta 89.94922797
_cell_angle_gamma 89.77499762
_space_g... | data_image0
_chemical_formula_structural Li8V11Bi4O32
_chemical_formula_sum "Li8 V11 Bi4 O32"
_cell_length_a 8.71215
_cell_length_b 8.79877885
_cell_length_c 8.80335959
_cell_angle_alpha 89.98981681000001
_cell_angle_beta 89.94922797
_cell_angle_gamma 89.77499762
_space_g... |
RemoveAtomAction | eb3a2d96-7551-46e9-a791-07584c04ab81 | mp-1245147 | Remove the atom at index 72 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cr16Fe16O48
_chemical_formula_sum "Cr16 Fe16 O48"
_cell_length_a 10.0212608
_cell_length_b 10.93656827
_cell_length_c 9.347078629999999
_cell_angle_alpha 91.27039423999999
_cell_angle_beta 93.00455529
_cell_angle_gamma 89.3856701099... | data_image0
_chemical_formula_structural Cr16Fe16O47
_chemical_formula_sum "Cr16 Fe16 O47"
_cell_length_a 10.0212608
_cell_length_b 10.93656827
_cell_length_c 9.347078629999999
_cell_angle_alpha 91.27039423999999
_cell_angle_beta 93.00455529
_cell_angle_gamma 89.3856701099... |
RemoveAtomAction | 0f2e0634-8d72-45c7-97d4-d4d9992e6b39 | mp-1219581 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rb2Mg2Al2F12
_chemical_formula_sum "Rb2 Mg2 Al2 F12"
_cell_length_a 7.15675315
_cell_length_b 7.156753149999999
_cell_length_c 7.15675315
_cell_angle_alpha 120.42557155
_cell_angle_beta 119.40563128000001
_cell_angle_gamma 90.148508... | data_image0
_chemical_formula_structural Rb2Mg2Al2F11
_chemical_formula_sum "Rb2 Mg2 Al2 F11"
_cell_length_a 7.15675315
_cell_length_b 7.156753149999999
_cell_length_c 7.15675315
_cell_angle_alpha 120.42557155
_cell_angle_beta 119.40563128000001
_cell_angle_gamma 90.148508... |
RemoveAtomAction | 43842b45-e39e-4152-ab5d-33a9355ef2d9 | mp-776732 | Remove the atom at index 7 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li2Fe3F8
_chemical_formula_sum "Li2 Fe3 F8"
_cell_length_a 6.2334377
_cell_length_b 6.2334377
_cell_length_c 6.233437549999999
_cell_angle_alpha 59.31060473
_cell_angle_beta 59.310604729999994
_cell_angle_gamma 59.310609109999994
_... | data_image0
_chemical_formula_structural Li2Fe3F7
_chemical_formula_sum "Li2 Fe3 F7"
_cell_length_a 6.2334377
_cell_length_b 6.2334377
_cell_length_c 6.233437549999999
_cell_angle_alpha 59.31060473
_cell_angle_beta 59.310604729999994
_cell_angle_gamma 59.310609109999994
_... |
RemoveAtomAction | 8185301e-b1f3-43ed-ba59-a999fafc3bd7 | mp-779526 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Fe10O14F6
_chemical_formula_sum "Fe10 O14 F6"
_cell_length_a 4.66250841
_cell_length_b 4.662508409999999
_cell_length_c 15.263086439999999
_cell_angle_alpha 89.97313512
_cell_angle_beta 89.97313512
_cell_angle_gamma 91.42331972
_sp... | data_image0
_chemical_formula_structural Fe9O14F6
_chemical_formula_sum "Fe9 O14 F6"
_cell_length_a 4.66250841
_cell_length_b 4.662508409999999
_cell_length_c 15.263086439999999
_cell_angle_alpha 89.97313512
_cell_angle_beta 89.97313512
_cell_angle_gamma 91.42331972
_spac... |
RemoveAtomAction | 9f615e3a-0ea7-4915-b249-9df594a6cb05 | mp-776832 | Remove the atom at index 37 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mn7SbP12O48
_chemical_formula_sum "Mn7 Sb1 P12 O48"
_cell_length_a 8.4872352
_cell_length_b 8.47984749
_cell_length_c 11.82462584
_cell_angle_alpha 90.03725513
_cell_angle_beta 89.97815392000001
_cell_angle_gamma 90.01172787
_space... | data_image0
_chemical_formula_structural Mn7SbP12O47
_chemical_formula_sum "Mn7 Sb1 P12 O47"
_cell_length_a 8.4872352
_cell_length_b 8.47984749
_cell_length_c 11.82462584
_cell_angle_alpha 90.03725513
_cell_angle_beta 89.97815392000001
_cell_angle_gamma 90.01172787
_space... |
RemoveAtomAction | 66c7d608-ae8b-4070-9993-f7b8fe95d74f | mp-542493 | Remove the atom at index 24 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sc10Co8Si20
_chemical_formula_sum "Sc10 Co8 Si20"
_cell_length_a 11.95411681
_cell_length_b 11.95413612
_cell_length_c 3.9187231999999996
_cell_angle_alpha 90.00000677
_cell_angle_beta 90.00000261
_cell_angle_gamma 89.99945552
_spa... | data_image0
_chemical_formula_structural Sc10Co8Si19
_chemical_formula_sum "Sc10 Co8 Si19"
_cell_length_a 11.95411681
_cell_length_b 11.95413612
_cell_length_c 3.9187231999999996
_cell_angle_alpha 90.00000677
_cell_angle_beta 90.00000261
_cell_angle_gamma 89.99945552
_spa... |
RemoveAtomAction | 5cbd3d12-7c07-4e9b-a2c6-d84346b920ea | mp-1811207 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca2Ti4S8
_chemical_formula_sum "Ca2 Ti4 S8"
_cell_length_a 7.57230625
_cell_length_b 7.57230674
_cell_length_c 7.56058097
_cell_angle_alpha 119.44504818000001
_cell_angle_beta 121.60871166
_cell_angle_gamma 89.19031634999999
_space... | data_image0
_chemical_formula_structural Ca2Ti4S7
_chemical_formula_sum "Ca2 Ti4 S7"
_cell_length_a 7.57230625
_cell_length_b 7.57230674
_cell_length_c 7.56058097
_cell_angle_alpha 119.44504818000001
_cell_angle_beta 121.60871166
_cell_angle_gamma 89.19031634999999
_space... |
RemoveAtomAction | e8871a3b-b37f-461b-af8f-68de1d1e6560 | mp-1045681 | Remove the atom at index 26 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg8Sb8As16Se8O56
_chemical_formula_sum "Mg8 Sb8 As16 Se8 O56"
_cell_length_a 10.63966254
_cell_length_b 13.52879227
_cell_length_c 13.52471817
_cell_angle_alpha 81.13835569
_cell_angle_beta 66.83762353
_cell_angle_gamma 66.830633739... | data_image0
_chemical_formula_structural Mg8Sb8As15Se8O56
_chemical_formula_sum "Mg8 Sb8 As15 Se8 O56"
_cell_length_a 10.63966254
_cell_length_b 13.52879227
_cell_length_c 13.52471817
_cell_angle_alpha 81.13835569
_cell_angle_beta 66.83762353
_cell_angle_gamma 66.830633739... |
RemoveAtomAction | 871ea388-f5e5-40e9-b7dc-4728c51a7f58 | mp-2321 | Remove the atom at index 6 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Tb6Ge10
_chemical_formula_sum "Tb6 Ge10"
_cell_length_a 5.7646017
_cell_length_b 7.46210898
_cell_length_c 9.12937743
_cell_angle_alpha 82.99785231
_cell_angle_beta 71.59589664
_cell_angle_gamma 67.28637543
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural Tb6Ge9
_chemical_formula_sum "Tb6 Ge9"
_cell_length_a 5.7646017
_cell_length_b 7.46210898
_cell_length_c 9.12937743
_cell_angle_alpha 82.99785231
_cell_angle_beta 71.59589664
_cell_angle_gamma 67.28637543
_space_group_name_H-M_alt ... |
RemoveAtomAction | 2401e929-3dcd-4cc0-90a2-24b29ad148b2 | mp-1105652 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural YbCo4P12
_chemical_formula_sum "Yb1 Co4 P12"
_cell_length_a 6.71855447
_cell_length_b 6.718554469999999
_cell_length_c 6.71855447
_cell_angle_alpha 109.47122063
_cell_angle_beta 109.47122063
_cell_angle_gamma 109.47122063
_space_gr... | data_image0
_chemical_formula_structural YbCo4P11
_chemical_formula_sum "Yb1 Co4 P11"
_cell_length_a 6.71855447
_cell_length_b 6.718554469999999
_cell_length_c 6.71855447
_cell_angle_alpha 109.47122063
_cell_angle_beta 109.47122063
_cell_angle_gamma 109.47122063
_space_gr... |
RemoveAtomAction | bb06695e-2adf-43d4-9b58-c87522bcc6cd | mp-570598 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr2Si14N20
_chemical_formula_sum "Sr2 Si14 N20"
_cell_length_a 6.72778808
_cell_length_b 6.83504655
_cell_length_c 9.60918669
_cell_angle_alpha 73.85418394
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Sr2Si13N20
_chemical_formula_sum "Sr2 Si13 N20"
_cell_length_a 6.72778808
_cell_length_b 6.83504655
_cell_length_c 9.60918669
_cell_angle_alpha 73.85418394
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "... |
RemoveAtomAction | 0c0c752b-427b-4071-a1d8-8207e47a9a21 | mp-1238897 | Remove the atom at index 22 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ti4Cr4Ag4S16
_chemical_formula_sum "Ti4 Cr4 Ag4 S16"
_cell_length_a 6.475615
_cell_length_b 7.69109295
_cell_length_c 12.85135469
_cell_angle_alpha 98.47946294
_cell_angle_beta 95.52817443
_cell_angle_gamma 89.94978949999998
_space... | data_image0
_chemical_formula_structural Ti4Cr4Ag4S15
_chemical_formula_sum "Ti4 Cr4 Ag4 S15"
_cell_length_a 6.475615
_cell_length_b 7.69109295
_cell_length_c 12.85135469
_cell_angle_alpha 98.47946294
_cell_angle_beta 95.52817443
_cell_angle_gamma 89.94978949999998
_space... |
RemoveAtomAction | 1cbc9d38-6075-45a7-88ca-b23befa1ff2a | mp-541694 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K8Na12Si4P12
_chemical_formula_sum "K8 Na12 Si4 P12"
_cell_length_a 4.800822
_cell_length_b 13.222475
_cell_length_c 14.663715
_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 K7Na12Si4P12
_chemical_formula_sum "K7 Na12 Si4 P12"
_cell_length_a 4.800822
_cell_length_b 13.222475
_cell_length_c 14.663715
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RemoveAtomAction | 3c686dda-69cf-4892-bcf9-bdf30c98c176 | mp-2229552 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgTi4Zn2O10
_chemical_formula_sum "Mg1 Ti4 Zn2 O10"
_cell_length_a 3.941108
_cell_length_b 5.45161165
_cell_length_c 11.020717
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 111.19230556
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural MgTi3Zn2O10
_chemical_formula_sum "Mg1 Ti3 Zn2 O10"
_cell_length_a 3.941108
_cell_length_b 5.45161165
_cell_length_c 11.020717
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 111.19230556
_space_group_name_H-M_alt ... |
RemoveAtomAction | 85dd7d10-48ed-4207-a4c1-5cbe1e80cb6a | mp-755668 | Remove the atom at index 20 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Ti4Mn4O16
_chemical_formula_sum "Li8 Ti4 Mn4 O16"
_cell_length_a 5.99744383
_cell_length_b 6.03957809
_cell_length_c 8.730582660000001
_cell_angle_alpha 90.00022835
_cell_angle_beta 89.99975295
_cell_angle_gamma 90.09988504
_spa... | data_image0
_chemical_formula_structural Li8Ti4Mn4O15
_chemical_formula_sum "Li8 Ti4 Mn4 O15"
_cell_length_a 5.99744383
_cell_length_b 6.03957809
_cell_length_c 8.730582660000001
_cell_angle_alpha 90.00022835
_cell_angle_beta 89.99975295
_cell_angle_gamma 90.09988504
_spa... |
RemoveAtomAction | 06ce8332-4eae-4484-9b8b-be5db156f04b | mp-1233972 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K2MgFe4P6O16F12
_chemical_formula_sum "K2 Mg1 Fe4 P6 O16 F12"
_cell_length_a 7.43008289
_cell_length_b 7.97766556
_cell_length_c 10.67987818
_cell_angle_alpha 100.48071168
_cell_angle_beta 109.86194711999998
_cell_angle_gamma 91.902... | data_image0
_chemical_formula_structural K2MgFe4P5O16F12
_chemical_formula_sum "K2 Mg1 Fe4 P5 O16 F12"
_cell_length_a 7.43008289
_cell_length_b 7.97766556
_cell_length_c 10.67987818
_cell_angle_alpha 100.48071168
_cell_angle_beta 109.86194711999998
_cell_angle_gamma 91.902... |
RemoveAtomAction | 2a3d0b4a-72a5-40a8-a89d-b3cc38aa1554 | mp-1213157 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural CsScW2O8
_chemical_formula_sum "Cs1 Sc1 W2 O8"
_cell_length_a 5.9272544
_cell_length_b 5.9272544
_cell_length_c 8.105797
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000445999999
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural CsScWO8
_chemical_formula_sum "Cs1 Sc1 W1 O8"
_cell_length_a 5.9272544
_cell_length_b 5.9272544
_cell_length_c 8.105797
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000445999999
_space_group_name_H-M_alt ... |
RemoveAtomAction | a5414487-2c61-40ac-b201-2fef279dd21b | mp-771567 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural LiTi3MnCrP6O24
_chemical_formula_sum "Li1 Ti3 Mn1 Cr1 P6 O24"
_cell_length_a 8.62920587
_cell_length_b 8.62920587
_cell_length_c 8.62920614
_cell_angle_alpha 59.92284299999999
_cell_angle_beta 59.92284299999999
_cell_angle_gamma 59.... | data_image0
_chemical_formula_structural LiTi2MnCrP6O24
_chemical_formula_sum "Li1 Ti2 Mn1 Cr1 P6 O24"
_cell_length_a 8.62920587
_cell_length_b 8.62920587
_cell_length_c 8.62920614
_cell_angle_alpha 59.92284299999999
_cell_angle_beta 59.92284299999999
_cell_angle_gamma 59.... |
RemoveAtomAction | fe9b20e0-1903-416e-b4f7-25be9e352559 | mp-1017129 | Remove the atom at index 15 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg12Bi2Sb2
_chemical_formula_sum "Mg12 Bi2 Sb2"
_cell_length_a 5.312534
_cell_length_b 6.518096
_cell_length_c 11.369786
_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 Mg12Bi2Sb
_chemical_formula_sum "Mg12 Bi2 Sb1"
_cell_length_a 5.312534
_cell_length_b 6.518096
_cell_length_c 11.369786
_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 | 53759b6d-4948-4476-b131-dda89b2eedf9 | mp-551214 | Remove the atom at index 2 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ce2Cr2S4O2
_chemical_formula_sum "Ce2 Cr2 S4 O2"
_cell_length_a 5.95918329
_cell_length_b 5.95918329
_cell_length_c 8.0268865
_cell_angle_alpha 89.79610506000002
_cell_angle_beta 89.79610506000002
_cell_angle_gamma 36.96267960999999... | data_image0
_chemical_formula_structural Ce2CrS4O2
_chemical_formula_sum "Ce2 Cr1 S4 O2"
_cell_length_a 5.95918329
_cell_length_b 5.95918329
_cell_length_c 8.0268865
_cell_angle_alpha 89.79610506000002
_cell_angle_beta 89.79610506000002
_cell_angle_gamma 36.96267960999999
... |
RemoveAtomAction | c41fb8d1-7ce0-4e35-ac58-5b1b20c37b65 | mp-765641 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Fe8P8O32
_chemical_formula_sum "Li8 Fe8 P8 O32"
_cell_length_a 4.935367
_cell_length_b 7.702235
_cell_length_c 18.4794473
_cell_angle_alpha 89.25448525
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Li7Fe8P8O32
_chemical_formula_sum "Li7 Fe8 P8 O32"
_cell_length_a 4.935367
_cell_length_b 7.702235
_cell_length_c 18.4794473
_cell_angle_alpha 89.25448525
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 2027bde9-747c-49c1-9b5e-df7366bdaded | mp-1045890 | Remove the atom at index 23 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Zn2Co9O13
_chemical_formula_sum "Zn2 Co9 O13"
_cell_length_a 5.17148885
_cell_length_b 5.17148885
_cell_length_c 16.773860490000004
_cell_angle_alpha 81.65832548
_cell_angle_beta 81.65832548
_cell_angle_gamma 32.881875320000006
_sp... | data_image0
_chemical_formula_structural Zn2Co9O12
_chemical_formula_sum "Zn2 Co9 O12"
_cell_length_a 5.17148885
_cell_length_b 5.17148885
_cell_length_c 16.773860490000004
_cell_angle_alpha 81.65832548
_cell_angle_beta 81.65832548
_cell_angle_gamma 32.881875320000006
_sp... |
RemoveAtomAction | efb1447d-de65-491f-8638-52a5c51445a8 | mp-866871 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ca8Sn2S12
_chemical_formula_sum "Ca8 Sn2 S12"
_cell_length_a 7.95022386
_cell_length_b 7.95022386
_cell_length_c 7.95022379
_cell_angle_alpha 90.73042548
_cell_angle_beta 90.73042548
_cell_angle_gamma 90.7304229
_space_group_name_H... | data_image0
_chemical_formula_structural Ca7Sn2S12
_chemical_formula_sum "Ca7 Sn2 S12"
_cell_length_a 7.95022386
_cell_length_b 7.95022386
_cell_length_c 7.95022379
_cell_angle_alpha 90.73042548
_cell_angle_beta 90.73042548
_cell_angle_gamma 90.7304229
_space_group_name_H... |
RemoveAtomAction | edd05bec-e2a4-4f36-bb7b-4e44d9957340 | mp-754722 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Ti3MnO8
_chemical_formula_sum "Li4 Ti3 Mn1 O8"
_cell_length_a 10.46644375
_cell_length_b 10.46641435
_cell_length_c 14.82520226
_cell_angle_alpha 19.268148019999995
_cell_angle_beta 19.267467279999984
_cell_angle_gamma 33.2065633... | data_image0
_chemical_formula_structural Li4Ti3MnO7
_chemical_formula_sum "Li4 Ti3 Mn1 O7"
_cell_length_a 10.46644375
_cell_length_b 10.46641435
_cell_length_c 14.82520226
_cell_angle_alpha 19.268148019999995
_cell_angle_beta 19.267467279999984
_cell_angle_gamma 33.2065633... |
RemoveAtomAction | 126a9346-665a-43ab-a946-499896d7540f | mp-1520316 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KGdNb4O12
_chemical_formula_sum "K1 Gd1 Nb4 O12"
_cell_length_a 5.60185288
_cell_length_b 5.60185288
_cell_length_c 7.97247476
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.41459261
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural GdNb4O12
_chemical_formula_sum "Gd1 Nb4 O12"
_cell_length_a 5.60185288
_cell_length_b 5.60185288
_cell_length_c 7.97247476
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.41459261
_space_group_name_H-M_alt "P 1... |
RemoveAtomAction | 29d07a0b-538a-4d4f-a9b2-29b1a1437cc3 | mp-1042875 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mn4As8O28
_chemical_formula_sum "Mn4 As8 O28"
_cell_length_a 9.313185
_cell_length_b 6.942376
_cell_length_c 9.63071261
_cell_angle_alpha 74.29205336
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... | data_image0
_chemical_formula_structural Mn3As8O28
_chemical_formula_sum "Mn3 As8 O28"
_cell_length_a 9.313185
_cell_length_b 6.942376
_cell_length_c 9.63071261
_cell_angle_alpha 74.29205336
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RemoveAtomAction | 324364c7-24e9-4a9d-9fad-fcb2515bfb87 | mp-1102196 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Er4Ga4Ir4
_chemical_formula_sum "Er4 Ga4 Ir4"
_cell_length_a 4.26142818
_cell_length_b 6.73400898
_cell_length_c 7.72532401
_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 Er4Ga4Ir3
_chemical_formula_sum "Er4 Ga4 Ir3"
_cell_length_a 4.26142818
_cell_length_b 6.73400898
_cell_length_c 7.72532401
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RemoveAtomAction | 0095c0f8-2bd9-4ab0-923f-3c941805f9eb | mp-1207656 | Remove the atom at index 26 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Y4Pt4F28
_chemical_formula_sum "Y4 Pt4 F28"
_cell_length_a 5.41969803
_cell_length_b 8.78192589
_cell_length_c 11.88004866
_cell_angle_alpha 62.30397471
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Y4Pt4F27
_chemical_formula_sum "Y4 Pt4 F27"
_cell_length_a 5.41969803
_cell_length_b 8.78192589
_cell_length_c 11.88004866
_cell_angle_alpha 62.30397471
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... |
RemoveAtomAction | 5eac089d-6c74-4f36-83c7-15b83b4affbd | mp-28748 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Y6Ir2I6
_chemical_formula_sum "Y6 Ir2 I6"
_cell_length_a 4.2875557
_cell_length_b 8.80719215
_cell_length_c 12.26134567
_cell_angle_alpha 93.86336369
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... | data_image0
_chemical_formula_structural Y5Ir2I6
_chemical_formula_sum "Y5 Ir2 I6"
_cell_length_a 4.2875557
_cell_length_b 8.80719215
_cell_length_c 12.26134567
_cell_angle_alpha 93.86336369
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_... |
RemoveAtomAction | 2e313e32-f373-4b15-9daa-ec4e8f2cbe72 | mp-1226677 | Remove the atom at index 5 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural CeHo4S7
_chemical_formula_sum "Ce1 Ho4 S7"
_cell_length_a 6.79201866
_cell_length_b 6.792018659999999
_cell_length_c 11.609863210000002
_cell_angle_alpha 75.80654176
_cell_angle_beta 75.80654176
_cell_angle_gamma 32.62256165
_space... | data_image0
_chemical_formula_structural CeHo4S6
_chemical_formula_sum "Ce1 Ho4 S6"
_cell_length_a 6.79201866
_cell_length_b 6.792018659999999
_cell_length_c 11.609863210000002
_cell_angle_alpha 75.80654176
_cell_angle_beta 75.80654176
_cell_angle_gamma 32.62256165
_space... |
RemoveAtomAction | 1c43a517-7013-4479-8565-edbdecc1159f | mp-768873 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Y8Ge4O20
_chemical_formula_sum "Y8 Ge4 O20"
_cell_length_a 6.92273925
_cell_length_b 6.76157492
_cell_length_c 9.31830165
_cell_angle_alpha 80.69413633000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... | data_image0
_chemical_formula_structural Y8Ge3O20
_chemical_formula_sum "Y8 Ge3 O20"
_cell_length_a 6.92273925
_cell_length_b 6.76157492
_cell_length_c 9.31830165
_cell_angle_alpha 80.69413633000002
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt ... |
RemoveAtomAction | 044cc509-b164-433a-9523-abdac80150e5 | mp-1205559 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Yb2In2Br6
_chemical_formula_sum "Yb2 In2 Br6"
_cell_length_a 8.60833185
_cell_length_b 8.60833185
_cell_length_c 10.73531721
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 155.74950681
_space_group_name_H-M_alt "... | data_image0
_chemical_formula_structural Yb2InBr6
_chemical_formula_sum "Yb2 In1 Br6"
_cell_length_a 8.60833185
_cell_length_b 8.60833185
_cell_length_c 10.73531721
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 155.74950681
_space_group_name_H-M_alt "P... |
RemoveAtomAction | 0165acc5-a7d2-40e6-85dc-c007c4d25beb | mp-1201107 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Zn2B20H52O16
_chemical_formula_sum "Zn2 B20 H52 O16"
_cell_length_a 6.908729
_cell_length_b 7.43949478
_cell_length_c 18.47887034
_cell_angle_alpha 80.44130898999998
_cell_angle_beta 79.22597710000001
_cell_angle_gamma 62.3332663499... | data_image0
_chemical_formula_structural Zn2B19H52O16
_chemical_formula_sum "Zn2 B19 H52 O16"
_cell_length_a 6.908729
_cell_length_b 7.43949478
_cell_length_c 18.47887034
_cell_angle_alpha 80.44130898999998
_cell_angle_beta 79.22597710000001
_cell_angle_gamma 62.3332663499... |
RemoveAtomAction | 6d41163e-ee57-4fba-ae70-6f381e935b52 | mp-1228192 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Al8Si4Mo6
_chemical_formula_sum "Al8 Si4 Mo6"
_cell_length_a 4.8039013
_cell_length_b 4.803901299999999
_cell_length_c 13.45947417
_cell_angle_alpha 84.87054598
_cell_angle_beta 84.87054598
_cell_angle_gamma 119.30885929
_space_gro... | data_image0
_chemical_formula_structural Al8Si3Mo6
_chemical_formula_sum "Al8 Si3 Mo6"
_cell_length_a 4.8039013
_cell_length_b 4.803901299999999
_cell_length_c 13.45947417
_cell_angle_alpha 84.87054598
_cell_angle_beta 84.87054598
_cell_angle_gamma 119.30885929
_space_gro... |
RemoveAtomAction | ad93a863-c30b-4d54-a12b-d7df8e9bc4fd | mp-770527 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Mn8O18
_chemical_formula_sum "Li4 Mn8 O18"
_cell_length_a 4.93901349
_cell_length_b 4.93901349
_cell_length_c 13.586927
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999311
_space_group_name_H-M_alt "P ... | data_image0
_chemical_formula_structural Li4Mn8O17
_chemical_formula_sum "Li4 Mn8 O17"
_cell_length_a 4.93901349
_cell_length_b 4.93901349
_cell_length_c 13.586927
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999311
_space_group_name_H-M_alt "P ... |
RemoveAtomAction | 170d3f3b-9040-4c65-af78-deb64e5da9ab | mp-1080028 | Remove the atom at index 8 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 | 1624a3d5-7e5e-49ae-9920-765ce7ee2d5f | mp-1048821 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Al4Fe12O24
_chemical_formula_sum "Al4 Fe12 O24"
_cell_length_a 5.95108543
_cell_length_b 5.951085429999999
_cell_length_c 14.62563
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999368
_space_group_name_H-M_al... | data_image0
_chemical_formula_structural Al4Fe11O24
_chemical_formula_sum "Al4 Fe11 O24"
_cell_length_a 5.95108543
_cell_length_b 5.951085429999999
_cell_length_c 14.62563
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 119.99999368
_space_group_name_H-M_al... |
RemoveAtomAction | a8730e8a-8e1a-4e0f-b7a0-4f0a88c07649 | mp-559790 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K4Nb6Cl14O10
_chemical_formula_sum "K4 Nb6 Cl14 O10"
_cell_length_a 9.65668465
_cell_length_b 9.65668465
_cell_length_c 11.31733892
_cell_angle_alpha 69.91254741
_cell_angle_beta 69.91254741
_cell_angle_gamma 55.54566693999999
_spa... | data_image0
_chemical_formula_structural K3Nb6Cl14O10
_chemical_formula_sum "K3 Nb6 Cl14 O10"
_cell_length_a 9.65668465
_cell_length_b 9.65668465
_cell_length_c 11.31733892
_cell_angle_alpha 69.91254741
_cell_angle_beta 69.91254741
_cell_angle_gamma 55.54566693999999
_spa... |
RemoveAtomAction | ff3d02e8-ce32-4020-b5ac-ea22f4dc6be2 | mp-680113 | Remove the atom at index 18 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Cd11I22
_chemical_formula_sum "Cd11 I22"
_cell_length_a 4.34388855
_cell_length_b 4.34388855
_cell_length_c 81.037434
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000844999998
_space_group_name_H-M_alt "P... | data_image0
_chemical_formula_structural Cd11I21
_chemical_formula_sum "Cd11 I21"
_cell_length_a 4.34388855
_cell_length_b 4.34388855
_cell_length_c 81.037434
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000844999998
_space_group_name_H-M_alt "P... |
RemoveAtomAction | d97815a2-53c1-46b4-ab7a-db1f4b9664b5 | mp-759788 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4V2O6F2
_chemical_formula_sum "Li4 V2 O6 F2"
_cell_length_a 5.050479
_cell_length_b 5.21350892
_cell_length_c 5.795580870000001
_cell_angle_alpha 91.05051643
_cell_angle_beta 91.29622969
_cell_angle_gamma 111.69033657
_space_grou... | data_image0
_chemical_formula_structural Li4V2O5F2
_chemical_formula_sum "Li4 V2 O5 F2"
_cell_length_a 5.050479
_cell_length_b 5.21350892
_cell_length_c 5.795580870000001
_cell_angle_alpha 91.05051643
_cell_angle_beta 91.29622969
_cell_angle_gamma 111.69033657
_space_grou... |
RemoveAtomAction | 535d9fa0-7d9b-4e02-a4eb-902e9ca9a059 | mp-1218107 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr2Pr2Co2Ru2O12
_chemical_formula_sum "Sr2 Pr2 Co2 Ru2 O12"
_cell_length_a 5.662629
_cell_length_b 5.612396
_cell_length_c 9.70411899
_cell_angle_alpha 54.77886112
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_... | data_image0
_chemical_formula_structural SrPr2Co2Ru2O12
_chemical_formula_sum "Sr1 Pr2 Co2 Ru2 O12"
_cell_length_a 5.662629
_cell_length_b 5.612396
_cell_length_c 9.70411899
_cell_angle_alpha 54.77886112
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_a... |
RemoveAtomAction | 8c547e9a-e362-4e0f-9d98-9c1e197f9975 | mp-1202046 | Remove the atom at index 26 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr8P4I4O16
_chemical_formula_sum "Sr8 P4 I4 O16"
_cell_length_a 9.019828
_cell_length_b 8.540954
_cell_length_c 9.22496142
_cell_angle_alpha 67.48799209
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... | data_image0
_chemical_formula_structural Sr8P4I4O15
_chemical_formula_sum "Sr8 P4 I4 O15"
_cell_length_a 9.019828
_cell_length_b 8.540954
_cell_length_c 9.22496142
_cell_angle_alpha 67.48799209
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1... |
RemoveAtomAction | 3e56a6ad-e5de-42a0-bee5-85689f2d1d71 | mp-770417 | Remove the atom at index 3 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li4Mn2VNi3P6O24
_chemical_formula_sum "Li4 Mn2 V1 Ni3 P6 O24"
_cell_length_a 8.47454817
_cell_length_b 8.82226272
_cell_length_c 8.80750627
_cell_angle_alpha 60.09155733000001
_cell_angle_beta 59.35909993
_cell_angle_gamma 59.477256... | data_image0
_chemical_formula_structural Li3Mn2VNi3P6O24
_chemical_formula_sum "Li3 Mn2 V1 Ni3 P6 O24"
_cell_length_a 8.47454817
_cell_length_b 8.82226272
_cell_length_c 8.80750627
_cell_angle_alpha 60.09155733000001
_cell_angle_beta 59.35909993
_cell_angle_gamma 59.477256... |
RemoveAtomAction | 1d8b5a9e-cad6-47d1-8ebd-adb12777307c | mp-19420 | Remove the atom at index 9 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sr2MgWO6
_chemical_formula_sum "Sr2 Mg1 W1 O6"
_cell_length_a 5.60954906
_cell_length_b 5.60954906
_cell_length_c 5.60954906
_cell_angle_alpha 120.38451769000001
_cell_angle_beta 120.38451769000004
_cell_angle_gamma 89.3352761699999... | data_image0
_chemical_formula_structural Sr2MgWO5
_chemical_formula_sum "Sr2 Mg1 W1 O5"
_cell_length_a 5.60954906
_cell_length_b 5.60954906
_cell_length_c 5.60954906
_cell_angle_alpha 120.38451769000001
_cell_angle_beta 120.38451769000004
_cell_angle_gamma 89.3352761699999... |
RemoveAtomAction | b00d18f4-b66b-486f-9096-be546d65fbef | mp-570466 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Ca4
_chemical_formula_sum "Li8 Ca4"
_cell_length_a 6.19327088
_cell_length_b 6.1932687699999995
_cell_length_c 10.18371546
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000574000002
_space_group_name_H-M_a... | data_image0
_chemical_formula_structural Li8Ca3
_chemical_formula_sum "Li8 Ca3"
_cell_length_a 6.19327088
_cell_length_b 6.1932687699999995
_cell_length_c 10.18371546
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 120.00000574000002
_space_group_name_H-M_a... |
RemoveAtomAction | b21928dd-985e-4969-b4b3-b21d37dc8e63 | mp-1221954 | Remove the atom at index 1 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgTi2ZnO6
_chemical_formula_sum "Mg1 Ti2 Zn1 O6"
_cell_length_a 5.53855859
_cell_length_b 5.53855859
_cell_length_c 5.538558959999999
_cell_angle_alpha 54.98787810999999
_cell_angle_beta 54.987878110000004
_cell_angle_gamma 54.98787... | data_image0
_chemical_formula_structural MgTiZnO6
_chemical_formula_sum "Mg1 Ti1 Zn1 O6"
_cell_length_a 5.53855859
_cell_length_b 5.53855859
_cell_length_c 5.538558959999999
_cell_angle_alpha 54.98787810999999
_cell_angle_beta 54.987878110000004
_cell_angle_gamma 54.987877... |
RemoveAtomAction | 24da4aa7-3788-4df4-8d40-084e51624223 | mp-1229180 | Remove the atom at index 31 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ag8Sb5As3S16
_chemical_formula_sum "Ag8 Sb5 As3 S16"
_cell_length_a 5.973633
_cell_length_b 8.81196699
_cell_length_c 13.715369
_cell_angle_alpha 95.73033089
_cell_angle_beta 90.35217693
_cell_angle_gamma 90.08628863
_space_group_n... | data_image0
_chemical_formula_structural Ag8Sb5As3S15
_chemical_formula_sum "Ag8 Sb5 As3 S15"
_cell_length_a 5.973633
_cell_length_b 8.81196699
_cell_length_c 13.715369
_cell_angle_alpha 95.73033089
_cell_angle_beta 90.35217693
_cell_angle_gamma 90.08628863
_space_group_n... |
RemoveAtomAction | e7fdac90-728d-4120-ae34-1cfb2447b87d | mp-1232387 | Remove the atom at index 24 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Y8Mg4S16
_chemical_formula_sum "Y8 Mg4 S16"
_cell_length_a 7.962579
_cell_length_b 7.298803
_cell_length_c 11.468396
_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 Y8Mg4S15
_chemical_formula_sum "Y8 Mg4 S15"
_cell_length_a 7.962579
_cell_length_b 7.298803
_cell_length_c 11.468396
_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 | 5b173629-1838-452d-9270-7cc8c570d80a | mp-1216954 | Remove the atom at index 12 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Tm6Sc6Ge6
_chemical_formula_sum "Tm6 Sc6 Ge6"
_cell_length_a 6.11750201
_cell_length_b 8.67726062
_cell_length_c 9.09550533
_cell_angle_alpha 58.399634080000006
_cell_angle_beta 90.00032653
_cell_angle_gamma 90.00560102
_space_grou... | data_image0
_chemical_formula_structural Tm6Sc6Ge5
_chemical_formula_sum "Tm6 Sc6 Ge5"
_cell_length_a 6.11750201
_cell_length_b 8.67726062
_cell_length_c 9.09550533
_cell_angle_alpha 58.399634080000006
_cell_angle_beta 90.00032653
_cell_angle_gamma 90.00560102
_space_grou... |
RemoveAtomAction | 50479769-bb4d-471d-8e38-0cfde8274f91 | mp-2426125 | Remove the atom at index 8 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Mg18Sn10
_chemical_formula_sum "Mg18 Sn10"
_cell_length_a 8.88839894
_cell_length_b 8.888398940000002
_cell_length_c 8.88839933
_cell_angle_alpha 96.87517038
_cell_angle_beta 96.87517036999999
_cell_angle_gamma 96.87516981
_space_g... | data_image0
_chemical_formula_structural Mg17Sn10
_chemical_formula_sum "Mg17 Sn10"
_cell_length_a 8.88839894
_cell_length_b 8.888398940000002
_cell_length_c 8.88839933
_cell_angle_alpha 96.87517038
_cell_angle_beta 96.87517036999999
_cell_angle_gamma 96.87516981
_space_g... |
RemoveAtomAction | 532fa41c-e492-46fb-8562-7fa0c439814e | mp-1174883 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Li8Mn2Co4O14
_chemical_formula_sum "Li8 Mn2 Co4 O14"
_cell_length_a 5.09190036
_cell_length_b 5.09190036
_cell_length_c 18.027240309999996
_cell_angle_alpha 83.42724665
_cell_angle_beta 83.42724665
_cell_angle_gamma 32.6933560999999... | data_image0
_chemical_formula_structural Li8Mn2Co4O13
_chemical_formula_sum "Li8 Mn2 Co4 O13"
_cell_length_a 5.09190036
_cell_length_b 5.09190036
_cell_length_c 18.027240309999996
_cell_angle_alpha 83.42724665
_cell_angle_beta 83.42724665
_cell_angle_gamma 32.6933560999999... |
RemoveAtomAction | f9a87acc-36ea-47ed-a8d6-670c66df6fa2 | mp-1106406 | Remove the atom at index 15 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ce4Sn2S10
_chemical_formula_sum "Ce4 Sn2 S10"
_cell_length_a 3.93351799
_cell_length_b 7.87728947
_cell_length_c 11.4720556
_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 Ce4Sn2S9
_chemical_formula_sum "Ce4 Sn2 S9"
_cell_length_a 3.93351799
_cell_length_b 7.87728947
_cell_length_c 11.4720556
_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 | 2b4deada-6a8c-4418-9962-a9a18ba9c5d2 | mp-541006 | Remove the atom at index 25 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Ba4Tl4V4O16
_chemical_formula_sum "Ba4 Tl4 V4 O16"
_cell_length_a 6.013787
_cell_length_b 8.022234
_cell_length_c 10.631409
_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 Ba4Tl4V4O15
_chemical_formula_sum "Ba4 Tl4 V4 O15"
_cell_length_a 6.013787
_cell_length_b 8.022234
_cell_length_c 10.631409
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_spa... |
RemoveAtomAction | 1ab3dda1-eac5-47ba-838c-f5ac68a48b7f | mp-1211876 | Remove the atom at index 19 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural K4Hf24C4Cl60
_chemical_formula_sum "K4 Hf24 C4 Cl60"
_cell_length_a 9.739911
_cell_length_b 13.94139
_cell_length_c 18.577338
_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 K4Hf23C4Cl60
_chemical_formula_sum "K4 Hf23 C4 Cl60"
_cell_length_a 9.739911
_cell_length_b 13.94139
_cell_length_c 18.577338
_cell_angle_alpha 90.0
_cell_angle_beta 90.0
_cell_angle_gamma 90.0
_space_group_name_H-M_alt "P 1"
_s... |
RemoveAtomAction | 0b8ad81a-b151-4cfd-a53c-a63d16d60769 | mp-2232781 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural MgTi4Pb2O9F2
_chemical_formula_sum "Mg1 Ti4 Pb2 O9 F2"
_cell_length_a 3.75899027
_cell_length_b 8.611130359999999
_cell_length_c 7.98888701
_cell_angle_alpha 88.15670280999998
_cell_angle_beta 76.39283241
_cell_angle_gamma 77.392941... | data_image0
_chemical_formula_structural MgTi4Pb2O8F2
_chemical_formula_sum "Mg1 Ti4 Pb2 O8 F2"
_cell_length_a 3.75899027
_cell_length_b 8.611130359999999
_cell_length_c 7.98888701
_cell_angle_alpha 88.15670280999998
_cell_angle_beta 76.39283241
_cell_angle_gamma 77.392941... |
RemoveAtomAction | a9e988cd-f1cd-47b9-9bc1-75298ce2b2b9 | mp-1211275 | Remove the atom at index 4 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural KMg3Si4O12
_chemical_formula_sum "K1 Mg3 Si4 O12"
_cell_length_a 5.31933259
_cell_length_b 5.31933259
_cell_length_c 10.37244294
_cell_angle_alpha 85.73575754
_cell_angle_beta 85.73575754
_cell_angle_gamma 120.82269515
_space_group... | data_image0
_chemical_formula_structural KMg3Si3O12
_chemical_formula_sum "K1 Mg3 Si3 O12"
_cell_length_a 5.31933259
_cell_length_b 5.31933259
_cell_length_c 10.37244294
_cell_angle_alpha 85.73575754
_cell_angle_beta 85.73575754
_cell_angle_gamma 120.82269515
_space_group... |
RemoveAtomAction | 70462134-ebf3-415c-b880-765ecd8c7add | mp-568136 | Remove the atom at index 10 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Rb6V6Br18
_chemical_formula_sum "Rb6 V6 Br18"
_cell_length_a 12.89200448
_cell_length_b 12.891954179999999
_cell_length_c 6.45834038
_cell_angle_alpha 90.00080995
_cell_angle_beta 89.99957499999998
_cell_angle_gamma 119.999950160000... | data_image0
_chemical_formula_structural Rb6V5Br18
_chemical_formula_sum "Rb6 V5 Br18"
_cell_length_a 12.89200448
_cell_length_b 12.891954179999999
_cell_length_c 6.45834038
_cell_angle_alpha 90.00080995
_cell_angle_beta 89.99957499999998
_cell_angle_gamma 119.999950160000... |
RemoveAtomAction | 0ea7baf5-afcf-4e6b-807c-48108a215380 | mp-765621 | Remove the atom at index 0 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural V4F20
_chemical_formula_sum "V4 F20"
_cell_length_a 13.05659519
_cell_length_b 5.37688666
_cell_length_c 4.87872772
_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 V3F20
_chemical_formula_sum "V3 F20"
_cell_length_a 13.05659519
_cell_length_b 5.37688666
_cell_length_c 4.87872772
_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... |
RemoveAtomAction | b34b576e-5962-40bd-b3e1-a6b3bb1ce8f0 | mp-1104730 | Remove the atom at index 11 from the cif file. The indices of atoms are started from 0. | data_image0
_chemical_formula_structural Sm2Ni8Sn4
_chemical_formula_sum "Sm2 Ni8 Sn4"
_cell_length_a 6.71814651
_cell_length_b 6.71814651
_cell_length_c 6.7181465099999995
_cell_angle_alpha 107.69357689
_cell_angle_beta 110.36728819
_cell_angle_gamma 110.36728819
_space_... | data_image0
_chemical_formula_structural Sm2Ni8Sn3
_chemical_formula_sum "Sm2 Ni8 Sn3"
_cell_length_a 6.71814651
_cell_length_b 6.71814651
_cell_length_c 6.7181465099999995
_cell_angle_alpha 107.69357689
_cell_angle_beta 110.36728819
_cell_angle_gamma 110.36728819
_space_... |
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