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-978016
-7.907012
-5.300501
3.001047
other
La2Sn4Pd2
8
63
203.28
mp-1078628
-6.306442
-7.267607
2.483942
other
Na4Hg2Pb2
8
63
235.01
mp-504927
7.775936
10.171386
-3.724871
other
Cr2Cu2O8
12
63
147.23
mp-1078709
-5.837964
-6.207056
0.718718
other
Na4Bi2Au2
8
63
215.23
mp-20535
-5.842631
-3.415034
5.725853
other
Tb2Si2Rh2
6
63
109.74
mp-21027
-7.920033
-5.298497
3.433603
other
Ca2In4Pt2
8
63
182.1
mp-558690
13.721498
4.419924
-2.415746
other
Zn2B8O14
24
63
186.58
mp-22017
-8.34938
-5.037574
4.748334
other
La2In4Ir2
8
63
187.19
mp-732175
8.748978
1.125162
0.480919
other
Na6Ti2F16
24
63
315.42
mp-1079064
-7.759571
-2.898053
5.170466
other
Pr2Co2Ge4
8
63
149.45
mp-1025523
-5.338831
-2.693252
5.743135
original
Ce2Fe2Si4
8
63
134.76
mp-1105799
-5.614818
-2.048112
5.199275
other
Zr6Fe4Si6
16
63
252.92
mp-998429
9.201262
0.804911
0.093774
other
Ni2Ag2F6
10
63
127.18
mp-1209216
-8.27341
-2.501061
5.485894
other
Sm4Ga18Ru6
28
63
472.81
mp-998603
-0.218519
1.292037
-4.424724
other
Rb2Pb2Br6
10
63
367.8
mp-18209
-6.900549
-4.64823
5.164871
other
Pr4Zn6Ge12
22
63
447.94
mp-20754
-7.064979
-5.968958
3.741188
other
Li2Ce2Sn4
8
63
197.15
mp-1047395
6.945482
9.749484
-1.562723
other
Mg2Ag4O8
14
63
162.55
mp-31078
-6.934303
-3.271677
5.152564
other
Ce2Si2Rh4
8
63
146.14
mp-1193938
-6.857101
-1.8159
6.47348
other
Ce2Al20Fe4
26
63
401.55
mp-1106104
3.123596
2.8056
-3.547709
other
Al2I6N10
18
63
364.37
mp-779249
10.158518
9.425496
3.251682
other
Gd6Ta2O14
22
63
304.48
mp-758134
8.991733
0.797931
-0.235146
other
Li4Ag2F10
16
63
209.66
mp-1080816
-4.766642
0.189376
3.015755
other
Cr6P2N2
10
63
105.57
mp-1095484
-7.344047
-3.686982
5.972592
other
Pr2Al8Ni2
12
63
214.99
mp-510359
-7.647431
-4.597242
3.433406
other
Ce4Sn8Rh4
16
63
383.1
mp-1213916
-7.636367
-3.209447
5.692967
other
Ce4Al18Rh6
28
63
473.96
mp-1105754
-7.836603
-2.884613
5.352093
other
Er6Ge6Ru4
16
63
311.87
mp-19013
10.947393
12.768629
-3.5763
other
Li2V4O10
16
63
210.17
mp-22554
10.115101
4.693023
-7.026533
other
Mn2S2O8
12
63
143.84
mp-1225721
-6.0098
-5.690721
3.612641
other
Eu2Ga4Ge8
14
63
308.76
mp-9672
-3.684529
-4.395973
0.785695
other
K4Ni2P4
10
63
243.98
mp-17801
-6.786878
-3.612194
4.415056
other
Hf4Cu2Ge8
14
63
240.21
mp-1172893
-1.083116
2.956398
-3.015727
other
Cs4Cr4I12
20
63
1,240.65
mp-754713
9.614013
11.492871
-1.356884
other
Al8Cr4O20
32
63
327.15
mp-1095605
-7.362565
-3.657581
5.971623
other
Gd2Al8Ni2
12
63
205.96
mp-1245690
4.671547
2.292513
-3.157941
other
Sb2C12N18
32
63
531.29
mp-555247
10.86255
10.149985
1.985439
other
Dy6Re2O14
22
63
291.78
mp-752840
9.864178
9.225852
0.193153
other
Na12Sb2O10
24
63
339.14
mp-11401
-8.215679
-3.68408
4.730806
other
Sc2Ga4Ni2
8
63
122.48
mp-768518
11.189168
8.004253
1.813898
other
La6Al6O18
30
63
442.6
mp-3727
10.18525
9.477208
3.367238
other
Nd6Nb2O14
22
63
317.05
mp-1189416
7.531486
9.967849
-3.599426
other
Cr2Cu4O12
18
63
238.32
mp-758302
9.21766
0.708382
0.716526
other
Li2Ag2F4
8
63
102.77
mp-863757
-5.121405
-6.197437
0.562858
other
K4Sb2Au2
8
63
270.97
mp-1078225
-4.358489
-5.086308
5.593631
other
Ba2La2Si4
8
63
238.23
mp-1196000
6.346008
11.094931
0.473477
other
Ba12Fe12O32
56
63
840.96
mp-4406
11.114285
3.926462
-7.319211
other
Ca2S2O8
12
63
151.79
mp-20303
-8.160814
-5.527556
4.521765
other
La2In8Ni2
12
63
276.32
mp-767014
12.190643
11.112433
-1.272099
other
Na10W12O36
58
63
743.01
mp-13478
-5.206437
-3.485142
6.011574
other
Sm2Co2Si4
8
63
133.53
mp-11207
10.623166
10.152031
1.960227
other
Pr6Re2O14
22
63
321.98
mp-9881
-4.626357
-2.818929
-4.329848
other
K2Au2Se2
6
63
180.42
mp-21223
-8.096735
-5.44171
4.136793
other
Yb2In4Ni2
8
63
170.34
mp-1029338
0.49697
2.274949
2.108652
other
Li2V4N6
12
63
120.68
mp-27388
-5.207276
-3.816473
5.453819
other
Ba2Si4Ni4
10
63
198.35
mp-756779
5.42061
12.155521
-2.402919
other
Fe8O12F4
24
63
265.63
mp-1192913
-7.162074
-2.317238
6.475217
other
Gd2Al20Ru4
26
63
419.16
mp-11945
-7.373581
-3.652133
5.985448
other
Sm2Al8Ni2
12
63
208.8
mp-1077556
-7.125504
-5.477694
4.287775
other
Tb2Sn2Ge2
6
63
143.68
mp-1192563
-7.14169
-2.269575
6.579787
other
Lu2Al20Os4
26
63
415.1
mp-1227443
-6.228915
-6.635917
2.707806
other
Ba2Zn2Sn4
8
63
256.86
mp-21002
-8.240353
-5.061183
4.606403
other
La2In4Rh2
8
63
186.03
mp-1205610
-3.695472
-4.64608
0.713215
original
Cs4P4Pd2
10
63
322.95
mp-28582
5.628417
-0.355251
-3.175332
other
Cs2B6H16
24
63
298.62
mp-754276
8.35469
11.000402
-3.506763
other
Mn2Cr2O8
12
63
161.89
mp-1208027
-8.264322
-2.50683
5.514473
other
Tm4Ga18Ru6
28
63
472.3
mp-1323814
13.113373
11.480734
0.039533
other
Ca2V10O14
26
63
284.49
mp-7625
-4.069252
1.576506
3.119734
other
Y6Re2B14
22
63
262.1
mp-15326
7.765462
10.354863
1.706831
other
Sm6Ir2O14
22
63
296.78
mp-31046
-4.088078
1.635878
3.097713
other
Ho6Cr2B14
22
63
251.08
mp-756216
8.968071
6.63198
-3.89927
other
Eu2Se2O8
12
63
213.28
mp-1079513
-4.749637
-5.108636
0.21806
other
K4As4Pt2
10
63
282.53
mp-1042706
9.415501
14.44195
0.043459
other
Ca2Mn8O12
22
63
255.07
mp-1080784
-7.152389
-6.014231
3.898644
other
Li2Ho2Sn4
8
63
187.83
mp-28534
-0.237166
1.088961
-4.176786
other
Ca2In2Br6
10
63
327.87
mp-1102805
-5.142018
-1.952859
0.914991
other
Y4Ni4P4
12
63
205.3
mp-1047348
6.966787
9.798514
-1.699948
other
Zn2Ag4O8
14
63
163.71
mp-1105483
-7.387669
-5.25501
3.642935
other
Ce6Sn12Ru2
20
63
524.11
mp-9540
8.869001
1.939772
2.017074
other
Sm2Mg2F8
12
63
173.74
mp-1047339
11.238472
9.551188
0.06649
other
Zn2Sb4O8
14
63
193.41
mp-1227695
-3.538681
-2.101476
-5.437842
other
Bi4Pb6S12
22
63
587.67
mp-11078
-7.397642
-5.673469
3.557933
other
Ba2In4Rh2
8
63
213.7
mp-1047694
6.706487
13.318424
-1.423897
other
Ca2Co4O8
14
63
150.91
mp-1078782
-5.177693
-3.385416
5.986403
other
Y2Co2Si4
8
63
128.74
mp-756578
-1.228714
2.01728
-2.225243
other
La2Mg2I10
14
63
565.42
mp-1212223
-2.257762
0.447802
2.394459
other
Ho14Ru4C22
40
63
561.47
mp-755299
10.083957
0.556529
0.375874
other
Li2Fe2F8
12
63
156.08
mp-16504
-7.292689
-3.441757
6.059271
other
Ho2Al8Ni2
12
63
201.95
mp-5215
-7.650664
-3.367618
4.735157
other
Nd2Ni2Ge4
8
63
148.22
mp-998512
1.247962
2.260674
-5.325247
other
In2Pb2Cl6
10
63
307.77
mp-1041720
8.098466
13.463985
-0.863233
other
Mg2Fe4O8
14
63
142.48
mp-13520
-5.820271
-6.768848
3.168215
original
Na4Zn2Ge2
8
63
182.42
mp-772434
9.879445
12.437433
-0.523083
other
Li16Cr4O16
36
63
343.13
mp-7392
-5.316994
-6.195993
0.665819
other
Na4Ag2Sb2
8
63
209.09
mp-7095
-5.187312
-3.276699
5.828386
other
Ce2Co2Si4
8
63
132.65
mp-756705
11.307144
8.030632
2.000071
other
Y6Al6O18
30
63
397.16
mp-1043610
7.662214
13.301679
-1.346476
other
Ca2Co8O12
22
63
236.52
mp-18279
-6.67719
-3.363412
4.187003
other
Zr4Cu2Ge8
14
63
245.42
mp-19120
7.897004
10.027556
-3.920282
other
Mg2Cr2O8
12
63
144.77