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-1022071
-8.299465
-11.092579
5.935233
other
Mg12Co2Mo2
16
38
298.06
mp-974790
-5.63412
-7.075453
1.729105
other
Rb5Tl11Cd2
18
38
661.77
mp-1017477
-8.360006
-10.776477
6.436309
other
La2Mg12W2
16
38
366.87
mp-1021684
-7.304388
-11.083423
5.986692
other
Na2Mg12V2
16
38
363.86
mp-1219309
-7.505507
-5.586683
3.825071
other
Sm2Ni1Sn4
7
38
173.84
mp-1028169
-6.922483
-11.297251
6.062072
other
Ca1Mg14C1
16
38
362.33
mp-1223287
-6.966737
-4.93951
5.681661
other
La5Er5Ge6
16
38
436.98
mp-1021167
-8.208364
-10.291339
6.387021
other
Ce2Mg12Mo2
16
38
352.55
mp-1026679
-6.86587
-11.124949
5.802077
other
Rb1Mg14Ga1
16
38
393.68
mp-1016566
-6.588806
-11.275706
5.194904
other
Ba2Mg12Bi2
16
38
459.88
mp-1022471
-7.718789
-10.293056
6.402639
other
Mg12Zr2Ni2
16
38
326.48
mp-1027992
-7.404255
-11.095805
4.997982
other
Mg14Fe1Bi1
16
38
353.95
mp-1216079
-7.601748
-3.962189
5.952866
other
Y4Al4Co4
12
38
215.36
mp-1099301
-6.923562
-10.767282
6.448571
other
K1Mg6Ti1
8
38
199.85
mp-1026853
-6.768428
-11.317099
6.011472
other
K1Mg14C1
16
38
373.62
mp-1016570
-6.547133
-11.145254
5.874754
other
Ba2Mg12Ga2
16
38
428.86
mp-1026734
-7.0339
-11.334242
5.480053
other
Mg14Sn1C1
16
38
369.73
mp-1022576
-7.072318
-11.632797
5.643497
other
Mg12Zn2C2
16
38
300.09
mp-1225093
-7.065981
-4.015829
5.291264
other
Er2Cr1Ge4
7
38
141.44
mp-1021284
-7.605961
-10.285128
6.48837
other
Li2Mg12Nb2
16
38
335.97
mp-1023267
-6.887325
-10.887526
5.925434
other
Ca2Mg12Zn2
16
38
381.36
mp-1027814
-7.80081
-10.549168
6.31843
other
Mg14Nb1Fe1
16
38
331.81
mp-1017302
-6.935858
-10.942901
5.573048
other
Na2Mg12Ga2
16
38
365.34
mp-20337
10.63625
10.236662
3.034117
other
Zr1Pb1O3
5
38
76.36
mp-1016651
-8.411848
-11.175786
6.017928
other
Mg12Cr2Mo2
16
38
312.1
mp-753256
13.135199
0.578749
1.700711
other
Fe4O3F5
12
38
142.79
mp-1022643
-6.491835
-11.308281
5.846039
other
K2Mg12Zn2
16
38
407.15
mp-1224495
-7.018652
-1.800801
5.491704
other
Hf4Mn4Al4
12
38
199.94
mp-777672
10.37709
1.847365
2.216824
other
Li2Fe2F6
10
38
121.14
mp-1099284
-7.361504
-11.152491
5.456523
other
Li1Mg6Co1
8
38
155.63
mp-1017056
-8.264999
-11.901891
6.34863
other
Mg12B2W2
16
38
299.14
mp-778324
10.645858
0.7232
-0.991071
other
Co10O5F15
30
38
347.18
mp-1206261
-6.965505
-4.659227
5.010548
other
Sm2Ge6Au1
9
38
194.65
mp-1028226
-8.061483
-11.024616
5.990847
other
Mg14Al1W1
16
38
336.72
mp-1026800
-7.054572
-11.398381
5.723796
other
Mg14Si1C1
16
38
333.13
mp-1216295
-5.358127
-0.243195
3.51918
other
V1Re11B4
16
38
200.56
mp-1021390
-8.072269
-11.399096
5.641971
other
Mg12Sn2Mo2
16
38
330.66
mp-1028135
-7.097627
-10.99133
5.264085
other
Ca1Mg14Bi1
16
38
388.33
mp-1101724
10.630487
10.706959
2.067033
other
Nb10Pb14O39
63
38
962.13
mp-1099082
-7.262823
-11.033551
6.26849
other
Mg14Zr1B1
16
38
338.88
mp-1022460
-7.862256
-10.22712
6.43351
other
Mg12Zr2Cr2
16
38
346.34
mp-1021467
-6.44985
-11.516755
6.124069
other
K2Mg12B2
16
38
395.95
mp-1220534
-7.619308
-5.077398
3.649625
other
Nd2Sn4Ru1
7
38
185.06
mp-1219369
-7.923878
-3.094959
4.948223
other
Sc4Al4Ni4
12
38
186.81
mp-1021370
-7.580247
-10.430638
6.059367
other
Hf2Mg12Sn2
16
38
357.69
mp-1017462
-7.324351
-10.525155
5.731096
other
La2Mg12Sb2
16
38
409.44
mp-1028079
-7.456787
-10.48895
6.294113
other
Ce1Mg14Zn1
16
38
373.85
mp-1099113
-7.417112
-10.562291
6.235601
other
Ce1Mg14Co1
16
38
375.92
mp-1026876
-7.312765
-10.998485
5.235193
other
Mg14Cd1Cu1
16
38
348.09
mp-1023273
-7.74303
-10.209085
6.442865
other
Mg12Nb2Al2
16
38
326.98
mp-998150
8.358107
1.037752
1.573832
other
Ca1Tl1F3
5
38
88.93
mp-1016580
-8.589708
-10.941059
6.258585
other
Mg12Nb2W2
16
38
318.06
mp-1026531
-8.251942
-10.793623
6.29264
other
Mg14Nb1W1
16
38
337.94
mp-1028399
-7.404507
-10.962893
5.291642
other
Mg14Cd1Co1
16
38
340.71
mp-1217201
-6.640428
-1.334377
4.410677
other
Ti4Mn5V3
12
38
158.89
mp-1021272
-7.137237
-11.164651
4.766024
other
Li2Mg12Sb2
16
38
361.29
mp-1017269
-7.202595
-10.990438
4.641109
other
Mg12Ga2Sb2
16
38
357.09
mp-765681
6.152505
13.113891
-2.819271
other
Co8O12F4
24
38
226.7
mp-1217023
-5.164339
0.263313
3.236046
other
Ti1B2W1
4
38
41.04
mp-777326
12.101489
-0.763575
1.008203
other
Mn8O4F12
24
38
301.71
mp-1026499
-7.431278
-11.018293
5.0377
other
Mg14Cr1Bi1
16
38
365.24
mp-1016332
-6.728201
-11.029827
5.905965
other
Sr2Mg12Ga2
16
38
405.27
mp-1026490
-7.461637
-10.685122
6.196969
other
Mg14Ti1Si1
16
38
342.7
mp-1028354
-7.101973
-11.448505
5.647857
other
Mg14Ni1B1
16
38
333.18
mp-763008
8.771297
15.492186
-1.501066
other
Mn6O9F3
18
38
190.02
mp-1026517
-7.53777
-10.895892
5.593467
other
Mg14Cr1Ga1
16
38
348.32
mp-1022492
-7.029904
-10.347491
6.4569
other
Sr2Mg12Zr2
16
38
411.29
mp-1026607
-7.30144
-11.230031
6.13648
other
Ba1Mg14Mo1
16
38
383.02
mp-1220599
-6.141292
-1.500519
3.758997
other
Nb4V4Ni4
12
38
167.22
mp-1021545
-7.796757
-9.743712
6.749934
other
Ce2Mg12Ti2
16
38
370.76
mp-777333
14.234006
12.737434
-1.276306
other
V10O15F5
30
38
311.47
mp-1017086
-6.025941
-11.173302
5.936156
other
Cs2Sr2Mg12
16
38
508.62
mp-1023487
-6.889506
-10.695686
5.820811
other
Ca2Mg12Al2
16
38
383.5
mp-1028332
-7.494132
-10.400136
6.309117
other
Ce1Mg14Al1
16
38
375.97
mp-1099097
-7.005527
-10.634984
6.186219
other
Sr1Ce1Mg14
16
38
424.2
mp-1026745
-7.345506
-10.459914
6.112605
other
La1Mg14Cd1
16
38
387.36
mp-1220408
-5.777529
-2.844388
4.075865
other
Nb4Al4Zn4
12
38
182.82
mp-1018176
-2.979353
0.386039
2.689907
other
Gd1Fe1C2
4
38
50.35
mp-1226241
-6.064048
-0.83603
3.613147
other
Cr4Si4Mo4
12
38
156.57
mp-1023153
-6.910904
-11.134025
5.017352
other
Ca2Mg12Bi2
16
38
408.64
mp-1022141
-7.698718
-10.829239
5.419752
other
Mg12Co2Cu2
16
38
291.71
mp-1224367
-5.21912
-3.259614
4.000704
other
Hf4Ta4Si4
12
38
215.24
mp-1023234
-7.818161
-10.933242
5.526877
other
Mg12Mn2Co2
16
38
303.78
mp-1026672
-7.174533
-11.168826
5.102083
other
Mg14Si1Bi1
16
38
365.95
mp-1021387
-8.349008
-11.423031
5.799521
other
Mg12Sn2W2
16
38
327.76
mp-1027905
-7.251609
-11.117488
4.853703
other
Mg14Zn1Bi1
16
38
367.28
mp-1206837
-6.954111
-4.390313
5.157732
other
Sm2Cu1Ge6
9
38
184.84
mp-1226774
-5.559368
-3.624693
-1.060657
other
Ce1U1Te6
8
38
248.74
mp-1100161
-7.23499
-11.445193
6.120325
other
Mg6Cr1C1
8
38
149.69
mp-1021358
-7.481895
-10.442986
6.475054
other
Li2Mg12Ti2
16
38
346.03
mp-1215203
-6.298677
-2.391415
4.223934
other
Zr4V4Cu4
12
38
195.42
mp-1017195
-7.76058
-10.147767
6.457833
other
Hf2Mg12Cd2
16
38
353.66
mp-1021751
-6.739801
-11.323908
6.096507
other
Rb2Mg12V2
16
38
420.02
mp-1021291
-7.615112
-10.948094
5.909165
other
Li2Mg12Cr2
16
38
339.16
mp-1226780
-7.772011
-4.718006
4.679763
other
Ce2Ni1Pt1
4
38
90.79
mp-1017110
-7.815568
-10.129478
6.472442
other
Hf2Mg12Ga2
16
38
339.49
mp-1022591
-7.841098
-10.958629
5.763995
other
Mg12Zn2Cr2
16
38
328.74
mp-2219121
12.728084
13.006552
-1.069119
other
Mg1V4O8
13
38
142.22
mp-1247391
1.594025
2.142557
1.30409
other
Mg1Cu1N1
3
38
41.97
mp-1023248
-7.956126
-10.012062
6.610657
other
Ce1Mg6Mn1
8
38
173.59