mp_ID
stringlengths
4
10
x
float64
-10.28
17.7
y
float64
-12.01
23.9
z
float64
-8.99
7.96
type
stringclasses
2 values
formula
stringlengths
2
26
n_atoms
int64
1
444
spacegroup
int64
1
230
volume
float64
5.61
20.1k
mp-8888
11.898412
7.579342
0.784491
other
Ho4Al12Pb8O32
56
224
864.99
mp-554622
11.119257
11.15524
-2.700977
other
Rb6P2W24O80
112
224
1,772.13
mp-1196233
11.409941
7.817892
0.501227
other
Eu4Al12Pb8O32
56
224
856
mp-21618
11.860793
7.60767
0.834688
other
Nd4Al12Pb8O32
56
224
868.44
mp-1006615
3.579438
3.524306
-4.07661
other
Cr4Cu4N24Cl20
52
224
1,041.22
mp-1214478
7.805003
9.388811
1.442208
other
Ba8Sm2Cu6O18
34
223
556.92
mp-643409
7.723052
9.475349
1.44365
other
Ba8Y2Cu6O18
34
223
530.03
mp-1214501
7.787333
9.470986
1.455212
other
Ba8Ho2Cu6O18
34
223
540.18
mp-1096779
8.235857
9.321481
1.616369
other
Ba8Ce2Cu6O18
34
223
557.5
mp-1147699
8.210586
9.601483
1.540491
other
Ba8Ti2Cu6O18
34
223
506.97
mp-653337
7.300799
9.629501
1.115198
other
Ba8Yb2Cu6O18
34
223
541.29
mp-1023127
7.199969
9.665058
1.093274
other
Ba8Cu6Pb2O18
34
223
549.93
mp-1214933
7.817514
9.375772
1.408267
other
Ba8Gd2Cu6O18
34
223
550.86
mp-1214524
7.794408
9.434283
1.429965
other
Ba8Dy2Cu6O18
34
223
546.42
mp-1147655
7.932211
9.591399
1.430266
other
Ba8Cu6Sn2O18
34
223
528.56
mp-1205068
-2.786185
-0.606699
-5.222569
other
Rb8P6Pd6S24
44
223
1,832.95
mp-1247690
6.59978
12.227416
1.18275
other
Sr1Ca7Mn8O24
40
221
442.26
mp-1521540
11.453765
9.41479
2.940839
other
Ba4Nd4Zr8O24
40
221
596.8
mp-1518366
11.229093
11.870131
0.201507
other
Ca4Eu4V8O24
40
221
465.58
mp-1228031
2.010419
1.889526
1.291241
other
Ba8Sr1B6N12
27
221
521.23
mp-1076131
11.859895
10.540537
1.197918
other
La7Sm1V8O24
40
221
493.82
mp-1247642
6.698162
12.201888
1.172304
other
Ca8Mn7Cr1O24
40
221
440.9
mp-997591
10.687782
11.69212
3.376268
other
Cs1Na7Ta8O24
40
221
512.65
mp-1099685
5.269716
10.834622
-1.188087
other
Ba1Sr7Fe8O24
40
221
486.37
mp-1099824
6.380981
10.596112
-0.182966
other
Ba7Sr1Cu8O24
40
221
511.2
mp-1210163
7.545875
11.935063
1.651446
other
Nd5Mn8Pb3O24
40
221
477.7
mp-1076382
7.739485
11.086164
1.539559
other
La7Sm1Fe8O24
40
221
493.5
mp-1099778
9.592155
10.956388
3.391897
other
Ba1Sr7Ti8O24
40
221
496.06
mp-1228663
2.007811
1.90667
1.305069
other
Ba8Eu1B6N12
27
221
517.93
mp-997599
10.789018
11.747815
3.002161
other
Na8Ta7V1O24
40
221
496.54
mp-1214446
8.032452
9.73263
1.455653
other
Ba8Lu3Pt4O18
33
221
591.39
mp-1076445
5.286447
11.054694
-0.848664
other
Sr8Mn1Fe7O24
40
221
478.81
mp-1099881
7.192201
11.566828
1.924123
other
Sr8Ti4Mn4O24
40
221
480.58
mp-1099664
10.014731
12.272611
-3.444714
other
K1Na7V8O24
40
221
431.54
mp-1076485
6.658745
12.289524
1.129648
other
Ca7Mg1Mn8O24
40
221
435.56
mp-1247635
6.744762
12.141588
1.340435
other
Ca8Ti1Mn7O24
40
221
443.3
mp-1517211
6.853164
10.382925
-0.98945
other
Sr4Eu4Co8O24
40
221
640.17
mp-997587
10.55261
8.718218
2.361887
other
La7Sc1Al8O24
40
221
433.93
mp-1214459
8.042711
9.689973
1.502246
other
Ba8Ho3Pt4O18
33
221
607.67
mp-558206
11.236532
8.690555
1.219741
other
K9U6Bi1O24
40
221
673.86
mp-997588
10.592828
8.672261
2.351399
other
La8Al7B1O24
40
221
434.64
mp-1076128
5.733945
11.987626
-0.715648
other
Ca7Mg1Co8O24
40
221
430.02
mp-1077660
5.283183
10.928731
-1.01213
other
Sr8Fe7Co1O24
40
221
477.86
mp-997589
10.452823
8.712951
2.578768
other
La8Al7In1O24
40
221
460.1
mp-997590
10.322038
8.784658
2.215393
other
La8Mg1Al7O24
40
221
450.99
mp-1214436
8.010976
9.790277
1.389824
other
Ba8Dy3Pt4O18
33
221
595.22
mp-669550
-7.544457
-3.944155
5.784442
other
Ce3Mn1Al24Cu8
36
221
602.97
mp-1214448
8.152417
9.711696
1.63471
other
Ba8Sc3Pt4O18
33
221
567.08
mp-997585
10.521113
8.70838
2.422892
other
La8Al7Ga1O24
40
221
448.07
mp-1099923
8.0735
11.479457
2.173104
other
La7Sm1Mn8O24
40
221
488.26
mp-997586
10.513405
8.703978
2.424469
other
La7Y1Al8O24
40
221
439.33
mp-1521791
10.458665
9.911216
3.661283
other
Ba4Zr8Sn4O24
40
221
604.79
mp-1075922
9.632007
11.008409
3.365834
other
Sr7Ca1Ti8O24
40
221
488.39
mp-17972
8.867107
1.305357
0.547797
other
Zn4Hg4O2F12
22
227
300.46
mp-1212042
-1.963907
-7.86928
2.199091
other
Ta24Al8Co2C2
36
227
7,100.34
mp-17745
10.431295
0.609015
1.380991
other
Mn4Hg4S2F12
22
227
348.8
mp-6424
4.123919
2.191535
-3.07231
other
K4Zn2C8N8
22
227
511.84
mp-542029
12.375707
9.211137
2.465913
other
Ti12Al8Ni4O4
28
227
368.34
mp-646297
6.141867
4.998467
-4.501855
other
Hg8Pb4N12O38
62
227
937.22
mp-1179487
6.544252
5.757003
-3.82209
other
Ta12Hg2Br32O36
82
227
2,438.79
mp-510486
-5.646157
-1.541991
3.471221
other
Ta12Al8Co4C4
28
227
391.04
mp-542028
0.609382
1.206011
2.815233
other
Ti12Al8Ni4N4
28
227
367.89
mp-6820
9.19299
0.968901
0.163908
other
Cu4Hg4S2F12
22
227
324.42
mp-541145
7.811238
2.595095
-2.423377
other
Ge8C8S12F24
52
227
1,047.27
mp-1214464
7.036676
5.859537
-3.047575
other
Ca2Nb2O24F4
32
227
309.97
mp-6051
4.125368
2.178725
-3.019367
other
K4Hg2C8N8
22
227
552.6
mp-18626
9.449099
0.93181
0.213767
other
Ni4Hg4S2F12
22
227
321.15
mp-1246700
9.25877
0.805043
0.795489
other
Ca4Ni4S2F12
22
227
339.12
mp-505538
-5.358327
-2.167083
3.998951
other
Ti12Al8Ni4C4
28
227
376
mp-1181991
6.450668
5.637446
-3.845128
other
Nb12Hg2Br32O36
82
227
2,381.1
mp-20623
4.138648
2.229274
-3.05712
other
K4Cd2C8N8
22
227
557.28
mp-504704
9.31663
1.211994
-0.237252
other
Ni4Hg4O2F12
22
227
290.7
mp-541146
7.816271
2.639426
-2.377204
other
Ge8C8Se12F24
52
227
1,111.44
mp-571433
4.350735
2.211505
-3.251179
other
Na2B2C8N8
20
227
418.86
mp-868020
6.450909
5.636199
-3.840466
other
Nb12Cd2Br32O36
82
227
2,494.27
mp-14560
11.940253
10.545349
2.496613
other
Ca4Ta4O12F2
22
227
281.55
mp-555507
8.684035
1.150751
1.707217
other
Sr20Al4Cl2F50
76
227
1,146.09
mp-644763
12.358644
9.1556
2.592479
other
Zr16Fe8H8O4
36
227
510.37
mp-1179521
6.548468
5.762349
-3.828656
other
Ta12Cd2Br32O36
82
227
2,320.51
mp-1180959
5.977504
3.322015
-3.467249
other
Pd8C64N16Cl48
136
228
3,201.93
mp-1198081
5.895188
3.590443
-3.420134
other
Sn8C64N16Cl48
136
228
3,020.86
mp-1274020
12.796736
12.321265
0.135427
other
Li8Ti4V4O16
32
23
294.17
mp-569114
-4.616333
-3.077655
-3.79424
other
Ba1Ag2Sn1Se4
8
23
235.41
mp-2218471
7.198993
7.430534
-3.360089
other
K3Mg1Nb1O8
13
23
219.97
mp-1227693
12.867541
6.444056
-0.650414
other
Be12Al8Si24O73
117
23
1,389.62
mp-555166
-3.532288
-1.660089
-5.652033
other
Ba1Ag2Sn1S4
8
23
204.4
mp-1216619
-4.686131
-2.843404
-4.010464
other
Tl1In2Ga1Se4
8
23
226.68
mp-569790
-4.621636
-3.018017
-3.822498
other
Ba1Ag2Ge1Se4
8
23
223.01
mp-2228166
11.792808
11.599013
-2.161541
other
Mg1V1Ag3O4
9
23
143.46
mp-2240261
-4.60617
-1.107661
-5.356088
other
Na2Mg1Fe2S4
9
23
212.25
mp-2224211
-4.406391
-1.361925
-5.699327
other
Mg1Cu2Ge1S4
8
23
165.78
mp-2217188
11.361915
10.729391
-0.694734
other
K3Mg1V1O4
9
23
183.82
mp-1223723
-2.584615
-0.655379
-5.333962
other
K8La1P4S16
29
23
810.05
mp-1219658
-3.283081
-1.227736
-5.230117
other
Rb8Nd1As4S16
29
23
929.27
mp-1223693
-4.22699
-2.592369
-3.492552
other
K8La1P4Se16
29
23
922.59
mp-2217098
11.576965
10.038001
1.298867
other
La2Mg1Mo1O6
10
23
168.98
mp-1216591
-6.11722
-3.499644
-2.210237
other
Tl1In2Ga1Te4
8
23
263.49
mp-2217255
11.530862
10.787466
-0.097066
other
Na3Mg1V1O4
9
23
142.92
mp-10811
2.114903
1.9482
1.332562
other
Na1Sr4B3N6
14
229
218.75
mp-1201730
2.822318
-0.581252
-1.708476
other
Er6Al4Ni12H14
36
229
379.06