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-8755
-5.884799
-3.744937
-2.089133
other
K4Na4Te4
12
62
408.29
mp-1105711
1.607024
2.252789
-4.175117
other
Mg4Br8O4
16
62
389.91
mp-770296
9.382312
8.828835
2.537345
other
La16Zn12O36
64
62
916.06
mp-27373
8.569084
2.196402
0.88635
other
Sn4Cl4F4
12
62
277.43
mp-985704
-2.892229
0.464185
2.552362
other
Ce8Re4C8
20
62
348.1
mp-1193520
-4.144908
-4.336521
-3.789198
other
Sr4Er8Se16
28
62
763.3
mp-1191565
-2.810017
-2.808742
-4.444348
other
Sm8P8S8
24
62
509.34
mp-752442
9.719362
8.459737
3.239819
other
Ba4Lu8O16
28
62
410.02
mp-1210991
-7.575724
-1.883322
3.008386
other
Lu4Si12Ni20
36
62
459.15
mp-27740
8.872266
1.772177
1.731203
other
Na4Np8F36
48
62
651.29
mp-1246389
1.838164
2.286101
0.459405
other
Cs4Cd4N4
12
62
351.44
mp-20172
-7.322285
-1.963925
5.789657
other
Er4Mn4Ge4
12
62
225.5
mp-7792
-2.623678
-2.71095
-5.603344
other
Y4Sc4S12
20
62
426.6
mp-20383
-5.666201
-3.298154
5.838774
other
Tb4Si4Ir4
12
62
215.99
mp-1211648
-0.212049
1.105931
-4.207153
other
K4Ca4Br12
20
62
671.37
mp-1102631
-7.934901
-4.563202
3.655013
other
Ca4Al4Pt4
12
62
239.17
mp-756166
9.772689
8.335774
3.185035
other
La4Ho4O12
20
62
306.55
mp-1202662
-5.696556
-1.482798
4.222298
other
Sc8Si16W12
36
62
565.67
mp-606503
-8.198377
-6.429866
3.007348
other
Ca12In4Au12
28
62
686.2
mp-770816
10.322644
9.682321
3.25628
other
Dy8Ti4O20
32
62
428.01
mp-754208
10.170582
8.425593
2.24793
other
Er4In4O12
20
62
263.67
mp-1193207
-2.70089
-2.671992
-5.88651
other
Ho8Zn4S16
28
62
661.12
mp-1210334
2.859041
3.017334
-4.223579
other
Nd4N8Cl20
32
62
837.09
mp-25265
10.097098
8.978074
-6.26423
other
V4P4O20
28
62
330.3
mp-1208034
-2.981393
0.244542
2.649487
other
U8Ni4C12
24
62
300.02
mp-20777
-7.772572
-2.990417
5.435147
other
Sm4Co4Ge4
12
62
221.3
mp-1003920
8.473414
14.666431
-1.317078
other
Mn8H4O16
28
62
285.27
mp-613677
-7.387679
-1.733983
5.956846
other
Gd4Mn4Ge4
12
62
220.28
mp-3081
12.469207
7.32777
0.32877
other
Be4Al8O16
28
62
227.11
mp-626270
8.876331
13.82105
-1.321509
other
Mn4H4O8
16
62
140.16
mp-1213983
-6.327408
-5.275084
0.849525
other
Ca4Bi4Pd4
12
62
291.54
mp-1213568
7.197251
9.375031
-1.17452
other
Cs4Tl12O20
36
62
627.09
mp-1247828
12.659666
7.019762
0.727741
other
Al12O12F12
36
62
385.89
mp-753299
9.08276
0.80644
0.682065
other
Li4Ag4F8
16
62
224.81
mp-1102216
-5.815815
-3.051326
5.378393
other
U4Si4Ru4
12
62
206
mp-17638
-4.641844
-2.929382
-3.616577
other
Rb12Sb4Se16
32
62
1,194.16
mp-1201635
-4.110397
-4.045947
-3.648898
other
Tb8Zr4Se20
32
62
752.74
mp-1209016
-7.055736
-4.641601
5.784496
other
Sm12Ni4Ge8
24
62
567.78
mp-22616
9.506275
7.378217
-3.024531
other
Co4Se4O12
20
62
234.63
mp-20249
-6.294054
-0.724493
1.821486
other
Mn4Co4P4
12
62
135.99
mp-582423
-0.398598
1.551472
-4.857496
other
Cs12Cu8Br20
40
62
1,453.06
mp-23442
1.323914
2.41354
-5.69385
other
K4Cd4Cl12
20
62
519.02
mp-19113
10.242435
9.66031
-1.850412
other
Co4Te4O12
20
62
247.81
mp-1195915
7.594766
9.540476
0.433594
other
Eu8Ti4O20
32
62
453.74
mp-1102568
-8.246669
-6.35035
3.028385
other
Eu4Zn4Au4
12
62
267.64
mp-21051
-7.859024
-5.167483
3.403263
other
Eu4In4Pt4
12
62
282.18
mp-1102933
-7.410713
-3.212562
4.18647
other
U4Ni4Ge4
12
62
208.9
mp-973217
-1.335172
1.905122
-3.527137
other
Sb4S4I4
12
62
415.41
mp-570300
1.534366
2.553823
-5.561137
other
Mn4Tl4Cl12
20
62
505.02
mp-1192374
-4.744589
-4.830269
0.209507
other
K4Ge12As12
28
62
744.78
mp-1213600
-0.367808
0.786503
-4.049401
other
Cs4La8Br28
40
62
1,528.28
mp-1246095
1.551056
2.006809
1.314304
other
Ca16Rh4N16
36
62
613.12
mp-1102455
-7.768625
-3.338274
4.770196
other
Dy4Ni4Ge4
12
62
209.32
mp-3009
8.655153
0.735919
1.380164
other
Rb8Be4F16
28
62
453.58
mp-20302
14.320393
6.826324
-2.542153
other
Fe8B4O16
28
62
288.38
mp-540586
10.240336
9.193787
-0.271283
other
Tl8Sn4O12
24
62
418.74
mp-7899
9.07735
8.681181
1.84511
other
Ba4Cd4O8
16
62
275.17
mp-728451
6.814646
5.898061
-4.326735
other
S4N16O20
40
62
756.28
mp-1044389
5.707053
11.149612
-1.66401
other
Ca4Fe12O28
44
62
627.03
mp-1189574
-3.158973
0.538299
2.702995
other
Y4W4C8
16
62
208.63
mp-1232261
-4.381786
-4.213192
-3.824837
other
Lu8Mg4Se16
28
62
762.72
mp-773011
11.719473
7.33467
0.212108
other
Dy8Ge8O28
44
62
613.78
mp-18331
10.341909
10.96859
1.861313
original
Gd4Cr4O12
20
62
224.6
mp-1105765
10.493482
11.832571
3.259435
other
Na4Nb4O12
20
62
246.9
mp-1208236
-6.223194
-3.585293
3.800748
other
U8Ta12Ge16
36
62
697.77
mp-1198541
-4.005348
-3.692868
-2.943163
other
Ca4U8Se20
32
62
780.8
mp-1199449
8.598847
14.211911
-1.150136
other
Mn36Pb16O80
132
62
1,676.19
mp-1237159
4.374508
3.006253
-4.094054
other
Te4S12N8
24
62
618.93
mp-1232100
-4.226331
-4.24216
-3.902329
other
Nd8Mg4Se16
28
62
808.05
mp-768243
10.255755
9.669174
3.374659
other
Tm8Ti4O20
32
62
408.16
mp-1213227
-7.639702
-1.93721
3.019197
other
Dy4Si12Ni20
36
62
458.82
mp-504532
10.938612
9.835759
-3.357552
other
As8W8O44
60
62
916.32
mp-686936
10.010283
11.558279
-4.27559
other
U4V8O32
44
62
757.7
mp-29988
1.609004
2.762062
-5.431503
other
Cs4Pd8Cl20
32
62
909.03
mp-1207673
-8.000087
-5.209048
2.694402
other
Yb8Sn20Pd12
40
62
898.2
mp-27425
10.780584
4.214627
-3.733836
other
Sr4H8O8
20
62
231.39
mp-1246151
-5.245404
-2.415813
-1.311792
other
Zr16Te12N8
36
62
775.8
mp-1208194
8.149566
2.168499
-1.170943
other
Ti4N8F20
32
62
477.59
mp-1213082
11.10133
8.100379
1.755316
other
Er4Ga4O12
20
62
223.63
mp-1247327
0.63737
2.39932
1.743973
other
K4Fe4N4
12
62
231.86
mp-978785
-6.11949
-3.63601
4.580965
other
Si16Mo4Pt12
32
62
473.55
mp-611033
7.505013
9.999917
-0.958545
other
Sr4Ru4O12
20
62
353.54
mp-1195823
-6.153139
-0.569417
1.503599
other
Sc4Co20P12
36
62
422.71
mp-1214463
6.812906
10.080745
-2.022386
other
Ba4Mn4O16
24
62
367.53
mp-1213713
1.256959
2.360592
-5.98634
other
Cs8Pr4Cl20
32
62
1,089.58
mp-24342
3.69846
-0.352515
-2.147579
other
Li4Be4H12
20
62
124.61
mp-1193794
10.575226
7.202581
-5.347313
other
Tl8P4O16
28
62
455.37
mp-1203072
9.674687
5.802941
-6.232692
other
U4S4O24
32
62
455.43
mp-1188931
-4.475189
1.417746
3.194983
other
Pu4B8Os4
16
62
200.38
mp-21826
-7.893025
-2.118081
3.148428
other
U4Ni20Ge12
36
62
501.49
mp-771126
10.217581
9.721683
3.329643
other
Lu8Ti4O20
32
62
401.65
mp-866503
-3.394098
-1.745207
-5.657155
other
Ca8Sn4S16
28
62
753.87
mp-22299
-7.873855
-4.62122
3.566583
other
Tb4Ni4Sn4
12
62
243.47
mp-1192048
4.183369
3.213643
-3.518242
other
Li4I4N16
24
62
525.12
mp-1224010
0.429543
1.90816
-4.556206
other
Hg4Br4Cl4
12
62
434.49
mp-1102342
-5.862794
-1.989293
4.930931
other
Hf4Cr4Si4
12
62
182.78
mp-18383
-3.425593
-1.282664
-5.426158
other
K12Nb4S16
32
62
952.52
mp-1203483
7.917102
0.572739
-4.021769
other
B4H24N4
32
62
233.85
mp-30206
6.639827
5.803316
-3.327023
other
Cs4Cl4O16
24
62
459.14
mp-1102834
-6.043165
-0.545284
2.043705
other
Cr4Co4P4
12
62
134.94