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-1949
-6.924033
-1.276648
4.636665
other
Ti4Mn8
12
194
173.04
mp-1087479
-7.595659
-0.288034
3.674484
other
Cr2Co6
8
194
88.77
mp-1186833
-7.183866
-0.863769
5.010953
other
Pu2Mn6
8
194
100.42
mp-1094978
-5.42731
-5.556169
4.393866
other
Hf2Mg2
4
194
123.93
mp-1197090
-9.31934
-1.395198
2.884122
other
Tb8Ni28
36
194
506.26
mp-1183742
-6.626627
-5.673584
5.544091
other
Ce6Ga2
8
194
200.05
mp-1102741
-6.570574
-3.425863
3.474567
other
Pu4Os8
12
194
216.36
mp-1400848
7.941874
7.663865
-3.38654
other
Te2O6
8
194
144.85
mp-1184681
-5.817554
-4.182055
4.228708
other
Hf6Sc2
8
194
180.4
mp-16775
-9.275177
-4.895947
3.526594
other
Cd4Cu8
12
194
172.09
mp-1773
-5.1208
0.704689
3.213814
other
Re2B4
6
194
54.68
mp-1187672
-7.801694
-6.802032
6.194925
other
Tm6Tl2
8
194
217.95
mp-2215
-7.966071
-7.760567
3.543651
other
Th2Hg4
6
194
155.85
mp-1187880
-7.18974
-6.811514
7.139767
original
Y2Tm6
8
194
247.68
mp-1185796
-8.442196
-10.049136
6.177043
other
Mg6Tc2
8
194
146.2
mp-1080254
-4.119016
-2.833195
-3.991922
other
Cs4Se2
6
194
262.17
mp-1185145
-5.020895
-4.378392
0.38251
other
La2As6
8
194
200.92
mp-983458
-6.427007
-6.674383
1.630111
other
Tl6Cl2
8
194
251.33
mp-1186731
-6.273015
-5.768263
6.772183
other
Pr6Si2
8
194
227.28
mp-841
7.422952
5.290854
-3.642852
other
Li4O4
8
194
63.11
mp-1256614
15.589249
5.669582
0.360204
other
Si36O72
108
194
2,182.48
mp-985284
-6.072087
-6.041989
5.796649
other
Ce6Pa2
8
194
207.69
mp-1185520
-6.383813
-5.577652
1.181631
other
Lu2Bi6
8
194
240.3
mp-1187755
-6.792328
-3.475488
5.472413
other
U2Al6
8
194
157.15
mp-1183339
-0.285959
0.937325
-3.893227
other
Ba2Br6
8
194
259.65
mp-1184172
-8.458793
-7.112755
3.328319
other
Er2Ag6
8
194
159.59
mp-984873
-7.081528
-1.645127
6.446719
other
Al6Fe2
8
194
109.43
mp-22138
-8.01709
-7.292279
4.079579
other
Gd2Cd6
8
194
189.85
mp-542377
-5.885086
-7.034039
2.692069
other
Na18Sn8
26
194
722.5
mp-1017533
2.215718
1.698483
1.958181
other
Y2N2
4
194
61.04
mp-1185473
-7.914481
-6.37332
6.108238
other
Lu6Sn2
8
194
212.79
mp-14018
-4.400266
-5.858073
0.675428
other
K6As2
8
194
297.32
mp-864995
-7.002815
-4.462138
6.444788
other
Dy2Al6
8
194
154.83
mp-862604
-5.5222
-0.709886
3.602926
other
Re6Ni2
8
194
109.43
mp-1222741
-6.747758
-6.729593
6.941302
other
La2Y2
4
194
141.94
mp-261
-5.379672
-6.351711
4.052847
original
Ba6Al10
16
194
473.44
mp-1187827
-6.587622
-6.661452
2.284767
original
Tl2In6
8
194
220.98
mp-973539
-7.012227
-4.380782
6.420279
other
Lu2Al6
8
194
147.39
mp-981249
-6.971756
-6.804229
7.11023
other
Y6Tm2
8
194
263.36
mp-984765
-4.840664
-6.732123
2.827136
other
Ba6Te2
8
194
344.08
mp-1184058
-8.020967
-1.609143
2.507727
other
Ga2Ni6
8
194
88.74
mp-1185530
-5.6833
-4.296686
4.102385
other
Lu2Zr6
8
194
196.31
mp-1185789
-7.825405
-11.047273
5.818483
other
Mg6Fe2
8
194
147.51
mp-1080667
-7.878701
-0.77633
3.7907
other
Al2Co6
8
194
91.11
mp-1183600
-7.059209
-6.943881
7.218272
other
Ca2Pr6
8
194
298.9
mp-7759
-6.547955
-6.414601
2.592886
other
Ba2Sn6
8
194
264.18
mp-1182102
3.280138
-0.739992
-2.461879
other
Ba2H4
6
194
104.41
mp-755189
12.1678
11.821362
-0.081774
other
Fe2O2
4
194
43.09
mp-1018019
-3.228236
-2.189816
-5.546134
other
Pb2S2
4
194
107.94
mp-28572
-0.170031
0.547027
-3.100667
other
La2Br4
6
194
226.27
mp-938875
-7.040465
-10.746116
4.480846
other
Mg18Sn6
24
194
530.1
mp-1822
-5.369568
-2.450009
2.04511
other
Ti4As4
8
194
138.53
mp-1006258
-5.738188
-4.754005
3.315437
other
Er2Pu6
8
194
223.09
mp-1189228
-8.360836
-6.891573
5.453715
other
Y8Zn12
20
194
531.42
mp-1184441
-5.500676
-7.141593
4.380515
other
Eu6Nb2
8
194
231.83
mp-10744
-5.437717
-3.886404
4.792034
other
Si6Pt4
10
194
159.18
mp-1185137
-6.458284
-6.482332
6.382237
other
La6Zr2
8
194
264.12
mp-979293
-7.022646
-6.65257
6.729305
other
Sm6I2
8
194
245.71
mp-1183383
-6.527252
-6.611635
6.202053
other
Ba2La6
8
194
337.81
mp-1186701
-7.703413
-6.737314
6.957774
other
Pr6Au2
8
194
235.82
mp-2216
-8.684133
-0.145113
4.445104
other
Ce4Co34
38
194
485.87
mp-16511
-6.790672
-2.079488
6.180183
other
Mn6Al20
26
194
381.21
mp-1185255
-6.803153
-6.354491
3.476419
other
Li6Rh2
8
194
107.71
mp-30498
-8.077474
-7.213495
3.973527
other
Tb2Cd6
8
194
192.34
mp-1183517
-7.444642
-7.157205
3.335312
other
Ca2Cd6
8
194
194.52
mp-1187477
-5.219367
-2.930929
2.815935
other
Ti6Te2
8
194
141.32
mp-1184792
-4.146129
-7.263327
2.297127
other
K6Ac2
8
194
499.28
mp-866184
-5.361431
-3.071437
3.538979
other
Ti6Pb2
8
194
147.59
mp-978088
-7.552873
-6.807044
7.170828
other
Pr2Lu6
8
194
252.38
mp-1184670
-5.819654
-3.677665
4.2274
other
Hf6Al2
8
194
161.5
mp-1101922
-7.35702
-0.167593
5.395792
other
Eu4Fe8
12
194
223.73
mp-1186159
-8.083873
-6.684776
2.745441
other
Np2Ag6
8
194
177.58
mp-1186013
-8.447209
-3.898588
2.058896
other
Mn2Pd6
8
194
119.64
mp-1186730
-7.06471
-6.849281
7.252038
other
Pr6Sc2
8
194
269.95
mp-1183264
-6.801635
-7.398365
6.977786
other
Ac2Pm6
8
194
300.48
mp-1186963
-5.500715
-4.496094
1.495947
other
Sc6As2
8
194
161.11
mp-1139
-7.192139
-0.248211
3.388982
other
Co6Mo2
8
194
90.92
mp-1198409
-9.102695
-6.429863
4.792297
other
Sm26Zn116
142
194
2,542.6
mp-30875
-5.723588
-3.166205
3.531739
other
Ti4Sn2
6
194
109.11
mp-1094664
-6.1727
-9.083112
5.647815
other
Mg2Al2
4
194
118.56
mp-599
-5.444488
-2.451078
-1.24342
other
Ti2Te2
4
194
87.22
mp-1187368
-7.555902
-1.233875
5.306241
other
Tb2Mn6
8
194
140.46
mp-24809
3.391229
-0.71988
-2.344844
other
Ca2H4
6
194
67.05
mp-1185353
-4.094514
-7.071151
1.984239
other
K6Ce2
8
194
783.13
mp-1187112
-4.874284
-7.328715
3.937297
other
Sr6Dy2
8
194
371.97
mp-1187375
-5.395917
-7.428142
4.334691
other
Tb2Eu6
8
194
316.3
mp-1185256
-5.899033
-6.569318
3.976513
other
Li6Np2
8
194
181.3
mp-1025443
-7.959017
-6.923255
3.997592
other
Th2Cd6
8
194
199.24
mp-1183180
-5.556371
-4.096725
5.935539
other
Al6P2
8
194
130.02
mp-1039495
-7.177089
-10.821552
4.672312
other
Mg4Cd2
6
194
135.03
mp-1190275
5.313821
2.290725
-3.262148
other
Ir4C16
20
194
214.95
mp-864915
-0.564152
0.825674
-3.672478
other
Hf2Br6
8
194
292.66
mp-1183122
-6.103341
-7.98495
5.53747
other
Ac6Si2
8
194
276.13
mp-1185935
-7.355122
-0.640176
4.184487
other
Mn6Os2
8
194
91.24
mp-1186008
-5.054373
-7.507059
3.04009
other
Na6Tc2
8
194
212.03
mp-1186987
7.054965
8.114186
-2.997135
other
Sc2O6
8
194
75.2
mp-1188147
-4.083261
1.402327
3.011382
other
B16Os4
20
194
159.45
mp-999117
0.199871
2.035645
2.044381
other
Tc2N2
4
194
39.31
mp-1183856
-7.16128
-6.635088
6.798627
other
Dy2Er6
8
194
248.26
mp-1183996
-8.948477
-4.68311
3.678993
other
Cu6F2
8
194
96.09