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-12723
-8.124981
-6.400346
3.074564
original
Ca2Au2
4
63
101.14
mp-6914
-5.921344
-7.03239
4.155561
other
Ca2Ga2
4
63
104.22
mp-31509
-5.554818
-6.924605
3.357574
other
Ba4In4
8
63
296.18
mp-1094502
-7.094802
-8.85377
6.582185
other
Mg4Ti2
6
63
123.21
mp-972175
-8.806484
-5.945214
3.050515
other
Zn6In2
8
63
148.86
mp-1038789
-6.488183
-7.254226
1.344161
other
Mg4Bi2
6
63
158.14
mp-1079902
3.578208
-0.492501
-2.454263
other
Sn2H8
10
63
130.77
mp-1189230
-6.177365
-7.4699
3.197607
other
Ca6Tl10
16
63
458.15
mp-1039393
-6.38211
-10.397857
5.827916
other
Ca2Mg4
6
63
168.58
mp-1007692
-8.060214
-4.584547
3.276445
other
Hf2Pd2
4
63
73.46
mp-1046039
13.16805
11.919077
-0.480516
other
V10O14
24
63
292.37
mp-1039421
-5.165421
-7.347826
3.952799
other
Ca4Mg2
6
63
214.5
mp-1009
-4.067455
-4.932139
5.742617
other
Sr2Si12
14
63
271.53
mp-255
-6.884613
-7.588244
2.201508
other
Na4Hg4
8
63
199.72
mp-1208530
-9.209277
-5.161039
2.864254
other
Zn148Pd42
190
63
2,831.83
mp-1232339
5.671368
2.047244
-2.784227
other
Li2C24
26
63
226.46
mp-1198760
-6.506444
-6.489368
2.05979
other
Na40Sn104
144
63
4,601.25
mp-1368296
9.393637
10.488116
-2.73503
other
Re4O14
18
63
260.22
mp-1086673
-5.845375
-3.454101
-1.672186
other
Dy2Te6
8
63
247.7
mp-11243
-9.14229
-6.428402
3.648615
other
Er2Au2
4
63
91.47
mp-1103932
-5.836605
-3.543271
-1.636956
original
Dy4Te10
14
63
419.94
mp-1047762
5.748986
11.592036
-1.639863
other
Ni4O8
12
63
120.6
mp-1094572
-6.793063
-9.69185
3.033623
other
Mg4Sb2
6
63
144.77
mp-569486
-8.019381
-6.786838
2.593437
other
Yb4Ag14
18
63
374.39
mp-1187899
-6.071494
-7.372687
4.567392
other
Yb4Mg2
6
63
205.18
mp-1065793
-6.720823
-4.297915
2.622833
other
Pu2Pt2
4
63
86.6
mp-1189484
-6.110821
-5.813668
3.999584
other
Eu6Ge10
16
63
376.29
mp-1043494
12.336087
10.681606
-1.142493
other
W4O10
14
63
272.68
mp-1077102
-7.184088
-5.7008
3.764307
other
Tm2Sn4
6
63
152.6
mp-1387551
-7.27151
-6.868504
6.673245
other
Y4Mg2
6
63
175.55
mp-999291
-8.617755
-5.984768
4.584782
other
Pr2Pd2
4
63
99.44
mp-1094616
-6.290735
-6.027439
3.594682
other
Mg2Ga4
6
63
115.1
mp-1094763
-7.387553
-7.104335
2.537184
other
Mg4Cd8
12
63
252.58
mp-2620
-4.995792
-4.358571
6.144901
other
Dy2Si2
4
63
85.93
mp-1104563
-7.671367
-3.132731
4.910968
other
Mn2Ga12
14
63
222.22
mp-20253
-5.796426
-5.663165
0.744622
other
In6Sb6
12
63
348.09
mp-1039242
-6.436656
-7.158808
1.276896
other
Mg4Bi2
6
63
156.46
mp-1104212
-5.890145
-3.639136
-1.446908
other
La4Te10
14
63
455.62
mp-1185822
-8.084022
-6.840485
2.339349
other
Mg2Ag4
6
63
105.93
mp-9971
-6.892073
-4.581653
5.706659
other
Y2Ge2
4
63
90.81
mp-1188109
-8.130398
-6.326435
5.486436
other
Ho6In10
16
63
404.53
mp-1080793
-5.633492
-3.180231
-1.073723
original
Pu2Te6
8
63
250.79
mp-16342
-6.956098
-4.404844
5.572664
other
Ho2Ge2
4
63
88.47
mp-864941
-7.444329
-5.762392
5.356148
other
Mg2Sc4
6
63
143.76
mp-1190232
-6.948414
-6.162487
3.188612
other
Yb6Sn10
16
63
440.24
mp-1205322
3.393864
-0.720231
-2.347269
other
Ca2H4
6
63
67.26
mp-1007691
-7.975366
-3.903411
3.432576
other
Hf2Pt2
4
63
74.13
mp-1016106
-9.414963
-5.561125
3.678927
other
Hf2Zn32
34
63
504.89
mp-1094170
-7.054228
-6.518586
6.256715
other
La4Mg2
6
63
194.38
mp-1188947
-8.049995
-6.325997
5.352416
other
Nd6In10
16
63
444.7
mp-1094460
-8.495528
-7.434628
3.714483
other
Mg2Zn4
6
63
104.01
mp-1018117
-7.976025
-4.479445
4.895228
other
Ce2Rh2
4
63
86.95
mp-15671
-5.368626
-0.222274
3.491382
other
Re6B2
8
63
99.24
mp-1094554
-6.838579
-9.801296
3.097827
other
Mg4Sb2
6
63
143.36
mp-1185940
-6.299614
-7.028161
2.373127
other
Mg2Pb4
6
63
174.58
mp-1078795
-6.732573
-4.438023
5.115191
other
Tm2Ge6
8
63
159.17
mp-1094593
-6.951712
-11.031987
5.494601
other
Li2Mg4
6
63
127.16
mp-1119
-5.838875
-3.667674
-1.534591
other
Nd4Te10
14
63
445.2
mp-1104400
-4.085306
-4.858174
5.780288
other
Na2Si12
14
63
265.77
mp-571571
-5.622286
-3.642112
-1.440006
other
Ce2Te6
8
63
253.18
mp-13450
-5.490435
-3.458277
2.194114
other
Hf6Sb6
12
63
274.5
mp-30564
-7.083472
-3.718265
5.716229
other
Th2Co2
4
63
81.56
mp-12754
-8.013179
-4.509939
4.009811
other
Th2Pt2
4
63
98.73
mp-600063
15.627431
5.665534
0.37198
other
Si24O48
72
63
1,397.07
mp-982070
-7.43299
-1.397031
3.716499
other
V4Ir4
8
63
109.81
mp-2264
-6.967082
-4.297677
5.526878
other
Er2Ge2
4
63
87.3
mp-973906
-6.892074
-4.405169
5.371889
other
Lu2Ge4
6
63
120.06
mp-10212
-6.911991
-4.062897
5.182619
other
Sc2Ge4
6
63
110.39
mp-11302
-8.007208
-7.299943
4.068182
other
Ho2Cd6
8
63
184.23
mp-560973
15.596499
5.6728
0.343673
other
Si18O36
54
63
992.34
mp-18731
9.419438
13.289496
-0.758174
other
Fe6O8
14
63
144.46
mp-1018087
-8.57557
-5.899562
3.391923
other
Ce2Au2
4
63
106.64
mp-504781
-1.279356
1.897838
-2.410012
other
Np2I6
8
63
320.84
mp-1189917
-7.408369
-7.393867
5.193359
other
Nd6Tl10
16
63
456.71
mp-1095654
-6.610259
-6.346073
3.154004
other
Si4Ag8
12
63
235.91
mp-9970
-7.12475
-3.838595
5.26807
other
Sc2Ge2
4
63
76.45
mp-1080276
-4.073318
-2.815413
-4.083385
other
Cs4Se2
6
63
277.81
mp-1180757
6.209778
4.007459
-3.442479
other
K2N4
6
63
97.59
mp-18680
-2.663652
-2.862841
-5.349908
other
Tm16S22
38
63
824.08
mp-1008505
-5.494688
-6.568732
3.15141
other
Ba2Pd2
4
63
124.85
mp-999177
-7.986902
-6.141917
6.153967
other
Sm2Ga2
4
63
101.46
mp-1183366
-6.993961
-7.012738
3.047953
other
Ba2Cd6
8
63
257.93
mp-1025400
1.571436
2.581277
-4.96028
other
Yb2Cl6
8
63
196.85
mp-1047607
9.27657
2.552149
0.008831
other
Mo2F10
12
63
171.68
mp-1018115
-3.197409
-2.170218
-5.573859
other
Pb2S2
4
63
106.65
mp-1188213
-6.286351
-0.308658
3.453252
other
Co8Mo12
20
63
285.45
mp-2383052
10.548394
11.167541
-3.105237
other
W2O6
8
63
115.57
mp-1345171
12.875391
10.076609
0.288659
other
W10O14
24
63
358.94
mp-1078573
3.738858
-0.247169
-2.360619
other
Ge2H8
10
63
86.67
mp-1078955
-6.047195
-7.436169
2.688227
other
Na4Tl4
8
63
235.99
mp-849537
12.569258
13.404568
-1.734515
other
V12O22
34
63
395.07
mp-1094658
-7.08794
-10.627812
5.072916
other
Mg4Ga2
6
63
122.34
mp-570403
-8.104922
-7.258255
3.991016
other
Tb2Cd6
8
63
187.21
mp-1094437
-7.820695
-10.614767
5.024816
other
Mg4Zn2
6
63
113.13
mp-1212407
-5.734715
-4.229776
2.358963
other
Hf6Bi6
12
63
294.82
mp-680682
-6.209212
-6.107392
3.724556
other
K12Ga52
64
63
1,454.99
mp-1041997
12.907149
11.015405
-0.907571
other
Mo2O4
6
63
95.69
mp-1064719
-7.673646
-5.634027
5.795375
other
La2Ni2
4
63
90.64
mp-1025472
-5.709252
-3.578681
-1.04126
other
Np2Te6
8
63
259.8
mp-23202
-1.190827
2.72501
-2.993957
other
In2I2
4
63
151.12