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-1201150
2.111721
1.979711
1.545131
other
Ho16N24
40
206
649.56
mp-1196493
-6.254808
-1.488555
4.501928
other
Be24Ru16
40
206
445.9
mp-1196079
-6.206987
-6.313804
0.805457
other
Mg24Bi16
40
206
1,261.57
mp-1056
9.991971
8.35784
3.185257
other
Tb16O24
40
206
606.46
mp-1196003
-4.9183
-4.74729
0.034918
other
Zn24As16
40
206
813.05
mp-1204405
9.512235
8.723047
-0.38071
other
Bi16O24
40
206
683.97
mp-1182469
7.453261
9.110336
0.22582
other
Eu16O24
40
206
644.97
mp-1103359
-6.182364
-2.286472
-0.843912
other
Co4Te8
12
205
257.51
mp-2280
-5.042484
-2.5113
-3.869876
other
Cu4Se8
12
205
230.83
mp-2142
-6.129928
-2.334617
-0.449613
other
Te8Os4
12
205
266.97
mp-983
-5.152408
-1.702982
-2.729482
other
Rh4Se8
12
205
221.48
mp-754
-6.175241
-2.382946
-0.731038
other
Te8Rh4
12
205
274.8
mp-570285
-0.199626
1.237693
-4.076891
other
Si8Br32
40
205
1,421
mp-569814
-0.740632
0.982051
-4.086053
other
Ti8Br32
40
205
1,498.95
mp-1102444
-2.469798
0.239974
2.376846
other
U4C8
12
205
157.01
mp-22619
-4.869851
-1.808843
0.939865
other
Ni4P8
12
205
160.82
mp-22864
-6.914705
-4.586355
0.455355
other
Bi8Pt4
12
205
310.28
mp-1014993
0.845818
2.301155
2.23028
other
Cr4N8
12
205
107.8
mp-697
9.530785
9.93856
-0.197945
other
Sn4O8
12
205
138.61
mp-558374
15.621077
5.650023
0.392865
other
Si24O48
72
205
1,136.6
mp-1356
-6.40438
-4.109764
0.765827
other
Sb8Pd4
12
205
277.33
mp-988945
-4.605437
-4.871751
0.295429
other
Al8As8
16
205
346.32
mp-23212
-0.328873
1.511138
-4.677539
other
Cu8Br8
16
205
333.05
mp-1199460
4.944531
2.648196
-3.628579
other
B48Cl48
96
205
2,000.29
mp-20284
8.829535
1.823189
-0.499088
other
Pd4F8
12
205
151.53
mp-1207486
-0.438767
0.997803
-4.015908
other
Zr8Br32
40
205
1,639.17
mp-1455
-5.428141
-0.650273
-4.48139
other
Mn4S8
12
205
168.49
mp-2282
-5.419037
-1.005005
-4.151361
other
Ni4S8
12
205
184
mp-1102002
-6.326469
-2.345176
-0.684913
other
Fe4Te8
12
205
246.65
mp-1101975
0.554978
2.659063
1.968087
other
W4N8
12
205
126.38
mp-21065
-3.129572
-3.72346
0.555526
other
Si4P8
12
205
187.21
mp-21268
-4.547243
-5.015682
0.302288
other
Si4As8
12
205
227.43
mp-1095224
7.902788
10.909013
-0.620409
other
Pt4O8
12
205
124.97
mp-21321
-5.376884
-1.901387
-3.767522
other
Mn4Se8
12
205
241.31
mp-22309
-5.371366
-1.447113
-2.940925
other
Co4Se8
12
205
203.68
mp-8909
7.948349
11.603543
0.358559
other
Ru4O8
12
205
113.54
mp-1068
-4.465786
-1.187188
-5.328428
other
Cu4S8
12
205
193.02
mp-7139
6.442019
5.14412
-4.057562
other
N8O4
12
205
210.28
mp-1102324
-6.201567
-2.378825
-0.914793
other
Ni4Te8
12
205
260.22
mp-680506
2.128345
2.714347
-4.265012
other
Pt8Cl32
40
205
1,514.86
mp-1095353
7.977098
11.12212
-0.489025
other
Ir4O8
12
205
117.89
mp-1102074
0.66484
2.119791
2.161569
other
Os4N8
12
205
116.11
mp-23266
-1.031851
2.485791
-3.124115
other
Ge8I32
40
205
1,860.84
mp-8484
7.578886
5.635206
-3.503804
other
Zn4O8
12
205
121.83
mp-1102429
1.150658
1.65125
2.74158
other
Hf4N8
12
205
134.86
mp-2513
-6.053968
-2.873367
0.632886
other
As8Pt4
12
205
216.9
mp-1102845
-4.039005
-0.313378
-4.463377
other
Ti4S8
12
205
216.71
mp-9258
12.816491
7.024743
-1.043159
other
Si4O8
12
205
90.39
mp-1102038
3.496374
-0.693169
-2.49458
other
Mg4H8
12
205
109.85
mp-1102261
-5.635055
-0.85543
-3.000474
other
Ir4S8
12
205
189.69
mp-1746
8.976404
0.88428
1.416782
other
Mg4F8
12
205
125.93
mp-22846
-4.034705
-1.318547
-5.716532
other
In40S32
72
205
2,052.84
mp-1101868
4.13179
3.245459
-3.769721
other
Au4N8
12
205
179.79
mp-971632
-3.409925
-3.965878
0.589388
other
Ga8P8
16
205
306.66
mp-20465
-6.038792
-3.304172
0.782306
other
As8Pd4
12
205
219.01
mp-1196483
9.522618
8.639175
-0.545607
other
Bi32O48
80
205
1,429.58
mp-1095264
8.152462
11.764779
0.171009
other
Os4O8
12
205
117.37
mp-23182
-1.030982
2.287679
-3.229468
other
Sn8I32
40
205
2,007.94
mp-1095493
-4.623321
-2.681294
-3.965183
other
Cd4Se8
12
205
307.13
mp-1102170
9.077703
13.700033
-2.014269
other
Cr4O8
12
205
113.1
mp-20412
-4.84733
-4.938737
0.151156
other
In8As8
16
205
433.14
mp-22555
-5.337905
-1.184066
-3.522114
other
Rh4S8
12
205
188.11
mp-2589
7.823222
5.495979
-4.092999
other
Mg4O8
12
205
112.58
mp-1080300
-4.25512
-4.284712
-3.433985
other
Ce4Se8
12
205
351.61
mp-1103420
0.599846
2.324499
1.938857
other
Re4N8
12
205
122.43
mp-1922
-5.203684
-1.64406
-2.35066
other
Ru4Se8
12
205
212.95
mp-1103235
-6.105489
-2.838378
-2.092298
other
Cu4Te8
12
205
292.53
mp-20901
-5.558317
-1.611873
-3.24487
other
Ni4Se8
12
205
218.84
mp-1102114
1.755257
2.171468
2.07687
other
Ta4N8
12
205
134.91
mp-571246
-0.257553
1.456357
-4.113825
other
Ge8Br32
40
205
1,449.32
mp-2633
11.154661
8.294452
-1.585744
other
Ge4O8
12
205
108.27
mp-1245822
-8.082745
-2.925485
2.638604
other
Co4Pt8
12
205
196.37
mp-2030
-5.288554
-0.898457
-3.429196
other
Ru4S8
12
205
178.51
mp-635441
-0.99395
2.058923
-2.885201
other
Si8I32
40
205
1,848.32
mp-1080852
-4.262296
-4.9859
-3.419631
other
Ce24Se48
72
205
5,398.36
mp-1103177
-5.681159
-1.598908
-2.880248
other
Fe4Se8
12
205
191.73
mp-15619
-4.783355
-4.864999
0.079101
other
Ga8As8
16
205
350.87
mp-1102235
0.697493
2.179595
1.880228
other
Ir4N8
12
205
114.48
mp-21873
-6.284711
-2.305747
0.865774
other
Ni4As8
12
205
189.72
mp-1102591
10.51656
12.361532
1.526119
other
Ti4O8
12
205
117.79
mp-1095440
-3.87241
-1.470493
-5.801125
other
Cd4S8
12
205
256.47
mp-15621
-5.285614
-5.754378
0.560625
other
Al8Sb8
16
205
441.17
mp-738
-6.113675
-4.900047
0.574207
other
Sb8Au4
12
205
305.6
mp-2718
4.685097
2.311782
-3.333292
other
C48N24
72
205
1,376.94
mp-23287
1.001308
1.946555
-5.375471
other
Cu8Cl8
16
205
276.08
mp-21893
-6.107145
-2.939313
-1.91391
other
Mn4Te8
12
205
342.91
mp-730
-5.233194
-2.065411
0.746404
original
P8Pt4
12
205
187.41
mp-1095618
0.797175
2.192878
1.834612
other
Pt4N8
12
205
115.41
mp-28988
-0.414945
1.179707
-4.509006
other
In28Br36
64
205
2,157.35
mp-998916
6.745195
6.074413
-3.801422
other
K4O8
12
205
238.76
mp-20066
6.769918
5.013189
-4.696898
other
C4O8
12
205
166.11
mp-1102811
-1.365791
0.558987
2.069433
other
Si4C8
12
205
109.64
mp-2604
-5.895885
-3.157107
-2.255583
other
Mg4Te8
12
205
356.02
mp-1102515
-4.644564
-2.601292
-3.998543
other
Zn4Se8
12
205
258.98
mp-1103427
1.083597
2.393531
1.347231
other
Pd4N8
12
205
135.53
mp-10720
-2.316345
0.507258
2.359543
other
Th4C8
12
205
195.59
mp-2480
-5.37629
-1.918893
-2.817094
other
Os4Se8
12
205
213.78
mp-1212517
-0.524155
0.970559
-3.881586
other
Hf8Br32
40
205
1,623.04
mp-1103590
-4.755982
-2.782095
-3.854062
other
Mg4Se8
12
205
269.59
mp-10844
-6.211572
-2.455734
-0.535197
other
Te8Ir4
12
205
280.06