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-760385
-7.562761
-6.54302
2.348476
other
In4Ag2
6
140
154.41
mp-9939
-6.023598
-3.528397
3.982198
other
Hf4Ge2
6
140
114.6
mp-16315
-7.850557
-3.029208
2.59217
other
Ge2Pt6
8
140
122.4
mp-30723
-6.432687
-6.183067
5.72695
other
Th4Hg2
6
140
178.22
mp-1195872
-7.954196
-6.47355
6.389269
other
Sm24Ga16
40
140
1,067.72
mp-1189085
-7.700845
-7.091977
5.560017
other
Er10Tl6
16
140
457.07
mp-570293
-5.594539
-2.563508
3.591087
other
Nb10Ga6
16
140
271.56
mp-567735
-5.167226
-4.552596
6.261646
other
Nd10Si6
16
140
426.4
mp-7506
-6.253484
-0.879168
3.986236
other
Cr10Si6
16
140
184.3
mp-569833
-6.072838
-3.564445
3.900868
other
Zr4Ga2
6
140
121.95
mp-21117
-6.573647
-0.986041
3.782345
other
Fe2Ge4
6
140
85.89
mp-542484
-5.476088
-7.30905
3.484508
other
Sr10Cd6
16
140
631.44
mp-1080448
-8.049399
-2.902602
2.669686
other
Al2Pt6
8
140
120.84
mp-20318
-6.352253
0.041051
3.391344
other
Mn4B2
6
140
52.78
mp-1651
-6.318396
-5.863808
5.82742
other
Th4Al2
6
140
169.35
mp-1105771
-7.476624
-7.035585
5.642955
other
Tb10Tl6
16
140
477.3
mp-17720
-5.886359
-6.993217
3.259912
other
Sr10Sn6
16
140
610.13
mp-1188287
-6.225773
-4.649315
2.832066
other
Pu10Pb6
16
140
458.63
mp-1214016
-5.984361
-6.91234
3.289743
other
Ca10Sn6
16
140
514.54
mp-570362
-5.622963
-7.232621
3.584745
other
Sr10In6
16
140
635.49
mp-15617
-5.500607
0.24154
3.226301
other
Cr10B6
16
140
144.38
mp-16724
-5.826433
-3.415105
4.228863
other
Zr10Al6
16
140
331.41
mp-17757
-5.718018
-6.681172
3.676389
other
Sr10Ge6
16
140
525.63
mp-1203103
-7.790074
-6.42152
6.300737
other
Nd24Ga16
40
140
1,110.63
mp-1105464
-5.835855
-4.608169
3.401596
other
Pu12Fe2
14
140
294.81
mp-1078656
-3.913105
-7.25945
2.015826
other
K6Mn2
8
140
422.05
mp-542019
-5.673362
-4.650244
4.234009
other
Np10Ge6
16
140
304.01
mp-30704
-5.692949
-2.747562
3.590479
other
Nb10Ga6
16
140
282.93
mp-1106252
-7.777833
-6.446578
6.347466
other
Nd10Ga6
16
140
451.56
mp-570287
-5.388938
-2.316445
3.448434
other
Ta10Si6
16
140
253.11
mp-1197194
-8.045806
-6.034032
6.267779
other
Ho24Ga16
40
140
952.41
mp-570696
-7.403671
-6.438509
5.145754
other
Pr10Sn6
16
140
510.43
mp-861
-6.276054
-3.783627
4.199113
other
Hf4Ni2
6
140
105.76
mp-493
-7.448148
0.558016
3.541607
original
Co4B2
6
140
52.21
mp-21428
-6.497725
-6.005879
5.695754
other
Th4In2
6
140
185.24
mp-2501
-5.789967
0.045799
3.290961
other
B2Mo4
6
140
73.03
mp-1185791
-7.761162
-10.510829
5.223731
other
Mg4Ni2
6
140
100.54
mp-1077157
-4.069695
-0.000205
2.419437
other
Ir2C4
6
140
54.67
mp-7022
-5.60995
-1.424755
2.149618
other
V10As6
16
140
217.55
mp-2536
-8.248077
-0.045811
2.359969
other
Ni4B2
6
140
51.13
mp-743
4.746949
2.955974
-3.388352
original
Rb2N6
8
140
149.35
mp-2851
-6.225064
-3.291356
1.071553
other
V2Sb4
6
140
121.11
mp-1080860
-4.266094
-4.98028
-3.421853
other
Ce16Se32
48
140
4,317.32
mp-1190061
-4.377695
-5.764436
5.32992
other
Eu10Si6
16
140
456.24
mp-9938
-5.329365
-3.477362
4.495505
other
Hf4Si2
6
140
110.83
mp-1198319
-9.127415
-5.760644
6.450448
other
Ho42Ir28
70
140
1,583.25
mp-1072518
-8.365693
-5.57108
3.258859
other
In4Cu2
6
140
131.72
mp-1212535
-5.870538
-0.731938
3.401851
other
Ge6W10
16
140
250.5
mp-1072181
-6.390101
-3.251019
0.715163
other
Fe2Sb4
6
140
120.59
mp-570896
-6.431669
-6.726274
1.942066
other
Tl4Pd2
6
140
135.64
mp-570469
-7.502309
-7.153303
5.955256
other
Pr10Tl6
16
140
511.62
mp-680302
-6.012465
-6.884781
3.271823
other
Ca62Sn40
102
140
3,178.56
mp-1247737
-7.62244
0.92184
5.078945
other
La2Fe18
20
140
272.82
mp-1077297
-6.796765
-3.277796
4.005907
other
Zr4Ir2
6
140
122.46
mp-1204352
-7.801827
-6.115628
6.14975
other
Y24Ga16
40
140
997.88
mp-1198715
-8.996564
-5.71172
6.251339
other
Er42Rh28
70
140
1,553.57
mp-1884
-5.734191
-6.490828
3.879276
other
Ca10Ge6
16
140
439.62
mp-1095094
-1.130397
2.428789
-3.219741
other
Sn2I6
8
140
408.41
mp-16370
-6.310071
-5.690262
5.782128
other
Th4Ge2
6
140
167.63
mp-1189576
-5.885437
-0.720547
3.379668
other
Ge6W10
16
140
248.14
mp-570175
-5.140898
-4.522559
5.819508
other
Ce10Si6
16
140
401.14
mp-1097011
3.545232
2.926383
-3.564576
other
I2N4
6
140
149.22
mp-746
-3.981246
-5.720909
5.266189
other
Sr10Si6
16
140
516.98
mp-20155
-7.371281
-3.886294
2.714112
other
Co2Sn4
6
140
108.32
mp-2783
-5.329479
-2.384952
3.443426
other
Ta4Si2
6
140
96.24
mp-12773
-5.802016
-3.488453
4.161016
other
Zr4Al2
6
140
126.04
mp-568411
-6.392048
-5.832675
5.736938
other
Th4Ga2
6
140
166.06
mp-554543
15.678963
5.638804
0.39135
other
Si8O16
24
140
437.4
mp-1950
-3.165109
-1.563325
-5.53052
other
Sr2S4
6
140
144.41
mp-1105805
-7.85793
-6.615839
6.500901
other
Pr10Ga6
16
140
451.43
mp-1204219
-9.084342
-5.90903
6.503883
other
Dy42Ir28
70
140
1,564.25
mp-998
-8.071338
-4.025317
5.179538
other
Al4Cu2
6
140
86.08
mp-1867
-5.750043
-2.030645
3.631303
other
Ta4Ni2
6
140
92.9
mp-1197692
-7.874552
-6.100863
6.200502
other
Tb24Ga16
40
140
1,009.46
mp-1629
-6.81447
-5.958146
5.577693
other
Th4Au2
6
140
167.85
mp-1196567
-9.144924
-5.643635
6.300536
other
Er42Ir28
70
140
1,565.82
mp-21108
-5.438232
-3.153334
3.669784
other
U12Fe2
14
140
270.14
mp-11278
-5.60888
-2.261274
3.701202
other
Ta4Be2
6
140
88.8
mp-982261
-4.369159
-2.869905
-3.869597
other
Pb2Se4
6
140
163.72
mp-1076974
-6.409225
-6.223607
5.55204
other
Th4Tl2
6
140
187.96
mp-1159
-6.014717
-3.239095
4.115071
other
Zr4Fe2
6
140
111.29
mp-1189870
-5.611373
-7.10834
3.917558
other
Ca10Ga6
16
140
467.58
mp-1105755
-7.646352
-7.10694
5.983206
other
Nd10Tl6
16
140
504.92
mp-2150
-5.81327
-3.78359
-1.481165
other
Ba2Te4
6
140
239.76
mp-510219
-7.826647
-3.829712
2.90159
other
Sn4Ru2
6
140
117.79
mp-1205197
-8.042492
-6.215723
6.251965
other
Dy24Ga16
40
140
992.28
mp-322
-3.533515
-1.802555
-5.501365
other
Tl4S4
8
140
213.72
mp-1198546
-8.131964
-5.941601
5.931663
other
Er24Ga16
40
140
960.23
mp-542342
-8.043509
-6.29601
6.313181
other
Dy10Ga6
16
140
406.78
mp-1080172
0.97016
1.798259
2.459087
other
Ti2N4
6
140
50.33
mp-1080631
-4.252262
-4.980599
-3.413512
other
Ce16Se32
48
140
4,551.22
mp-1212214
-7.770211
-7.185353
5.730693
other
Ho10Tl6
16
140
460.72
mp-1105948
-7.049165
-5.848625
4.346641
other
Ce10Sn6
16
140
473.62
mp-1989
-5.377872
-2.285372
3.441081
other
Ta10Si6
16
140
253.09
mp-1186834
-3.972398
-7.044153
1.937216
other
Rb4Mg2
6
140
358.5
mp-1025149
-5.141678
-2.494344
3.789568
other
Ti4B2
6
140
75.82
mp-571297
5.018579
3.325907
-3.573622
other
Ag2N6
8
140
102.31
mp-1332
-6.025301
-1.03706
3.490656
other
Si6Mo10
16
140
227.83
mp-16842
-5.697004
-2.225989
3.478159
other
Nb10Ge6
16
140
269.24
mp-1079083
-5.809158
-4.147696
4.43702
other
Si4Pd4
8
140
159.85