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-775277
11.401947
11.264672
-2.339932
other
K2W6O18
26
186
361.56
mp-29117
-1.178657
1.867139
-2.708906
other
Ta6Te2I14
22
186
771.49
mp-1197766
-6.72457
-4.934375
5.798003
other
Nd30Ge18C2
50
186
1,383.84
mp-1018697
-6.696724
-6.699118
2.985946
other
Eu2Cd2Sn2
6
186
169.57
mp-3481
-4.690201
-5.604367
0.482876
other
K2Sn2As2
6
186
190.65
mp-1246750
2.158239
2.208013
1.597281
other
Na2Ge2N2
6
186
87.87
mp-1180532
6.722066
7.219463
-3.826039
other
Li2Cl2O14
18
186
271.2
mp-13303
-8.686419
-6.18955
3.016191
other
Er2Sn2Au2
6
186
134.32
mp-1042444
10.604514
9.658524
-0.046041
other
Mg4Sb6O16
26
186
355.99
mp-1019101
-8.715859
-6.202547
3.187032
other
Sm2Ge2Au2
6
186
131.55
mp-19983
-7.709776
-4.769744
3.102899
other
Ti2Cu2Sn2
6
186
100.19
mp-1190624
-7.114653
-6.20373
4.304839
other
Li8Lu8Sn8
24
186
531.8
mp-1018695
-6.340561
-5.906456
0.867629
other
Eu2Bi2Au2
6
186
168.84
mp-1196963
-5.179014
-4.381153
6.019438
other
Er30Si18C2
50
186
1,147.42
mp-1214774
-7.372534
-5.296675
5.364181
other
Ce46Cd8Ir14
68
186
1,865.3
mp-1210297
-8.03024
-6.683779
6.668226
other
Pr46Cd8Pt14
68
186
2,064.47
mp-1197236
-8.117009
-6.799743
7.116029
other
Pr46Mg8Ru14
68
186
2,026.06
mp-1202680
9.362409
11.256371
-1.969912
other
Co12Te8O32
52
186
735.13
mp-532273
-5.874039
1.508109
-4.846664
other
Ba8Mo24S36
68
186
1,442.34
mp-754917
5.904003
12.928453
-1.533314
other
Li4Ni8O16
28
186
262.52
mp-29026
0.125069
2.200767
2.243286
other
Mn2W2N4
8
186
82.55
mp-1245800
0.554608
2.35034
1.829998
other
Sn2Os2N2
6
186
117.6
mp-12791
-7.970579
-5.495125
3.375941
other
Sm2Cu2Sn2
6
186
134.87
mp-9390
-7.949423
-4.405224
4.603004
other
Er2Cu2Ge2
6
186
108.89
mp-560684
12.67369
10.807717
-0.149298
other
La12Mo24O60
96
186
1,299.49
mp-619128
12.796398
12.751506
-0.928889
other
V12Pb2O22
36
186
414.6
mp-5114
-3.679723
-1.751688
-5.449121
other
K12Hg2S8
22
186
669.55
mp-1210413
-8.022636
-6.698325
6.909685
other
Pr46Cd8Rh14
68
186
2,002.46
mp-31447
-7.99052
-6.906213
3.90106
other
Tb2Ag2Pb2
6
186
148.75
mp-1191015
-7.187102
-6.255911
4.507216
other
Li8Nd8Sn8
24
186
607.06
mp-4304
-8.618112
-6.258295
2.981315
other
Sm2Sn2Au2
6
186
146.24
mp-570943
3.150826
-0.147013
-1.744358
other
La2Fe10H14
26
186
228.3
mp-1018713
-7.477852
-4.779414
3.359292
other
Hf2Cu2Sn2
6
186
109.85
mp-556049
0.120097
1.055431
-3.708039
other
Sr8Br12O2
22
186
646.58
mp-13406
-7.916492
-6.906867
3.824156
other
La2Ag2Pb2
6
186
165.6
mp-1096818
-4.295946
-1.314935
-6.050862
other
Al4Zn2S8
14
186
281.65
mp-1191507
-1.051275
2.071379
-2.207232
other
Eu8I12O2
22
186
760.02
mp-12171
9.412079
8.584848
0.369374
other
K12Mg2O8
22
186
407.07
mp-1208838
-6.329936
-4.468028
0.63641
other
Sm2Sb2Pd2
6
186
140.13
mp-7874
-5.982991
-6.145599
3.724014
other
Li2Ga2Ge2
6
186
102.01
mp-568155
-2.240847
0.434597
2.470488
other
U2Al6C6
14
186
173.19
mp-1206531
2.130065
2.888261
-3.729618
other
Sr2Cl2O2
6
186
152.56
mp-1048167
10.765882
9.339791
-0.117541
other
Ba2Sb8O14
24
186
663.67
mp-773167
7.550791
13.946799
-1.864596
other
Mn6Co2O16
24
186
249.01
mp-1042516
10.47994
9.758409
-0.195834
other
Zn4Sb6O16
26
186
354.99
mp-1224472
-5.151568
-4.561773
6.189736
other
Ho30Si18C2
50
186
1,169.63
mp-1192313
-6.859741
-5.544506
5.425288
other
Ce16Ga6Co2
24
186
579
mp-570855
-7.950108
-6.994784
4.004745
other
Sm2Ag2Pb2
6
186
153.88
mp-1208549
-3.34713
-0.367426
-4.399701
other
Ta2S4N2
8
186
171.56
mp-1024047
-4.806726
-3.128117
-3.949461
other
Na12Zn2Se8
22
186
532.44
mp-1225870
-3.503011
-0.769542
-4.659621
other
Cs2Ta2S6
10
186
288.41
mp-773120
8.51413
13.957561
-1.697626
other
Mn6Cr2O16
24
186
256.43
mp-774654
8.650684
13.988734
-1.623848
other
Mn6Sb2O16
24
186
281.37
mp-753473
6.038402
16.297388
-1.633889
other
Li2Co2O4
8
186
73.73
mp-1042707
11.600926
13.692682
-1.877542
other
Mg4V6O16
26
186
287.76
mp-1071260
-8.522645
-6.198523
3.02347
other
La2Sn2Au2
6
186
158.09
mp-1208609
-7.768697
-2.518337
3.683974
other
Tb6Co16Sn8
30
186
512.81
mp-23794
9.439709
1.622852
-3.967487
other
H8N2F2
12
186
120.07
mp-31160
-6.333042
-6.694733
3.22167
other
Ca2Zn2Sn2
6
186
141.99
mp-13212
-7.933869
-4.506186
4.746297
other
Gd2Cu2Ge2
6
186
116.61
mp-1212070
-7.704345
-6.175186
6.252661
other
La46Cd8Rh14
68
186
2,053.42
mp-1094004
-4.261038
-1.345925
-6.07555
other
Zn4Ga4S10
18
186
368.74
mp-757530
6.838197
13.207884
-2.262904
other
Co6Sb2O16
24
186
257.33
mp-559031
0.009812
1.068789
-3.778979
other
Eu8Br12O2
22
186
626.73
mp-1209183
-7.84949
-2.352598
3.604485
other
Sm6Co16Sn8
30
186
525.88
mp-757333
12.499647
7.540687
0.406295
other
Al24Pb2O38
64
186
610.75
mp-1245592
2.172571
2.159657
1.447759
other
K2Ge2N2
6
186
104.84
mp-1192296
-5.735007
-5.963681
0.776949
other
Li8Sn8Sb8
24
186
610.48
mp-1192267
-8.224601
-6.595539
6.389625
other
Ho16In6Co2
24
186
637.18
mp-28944
-5.818252
-3.218928
-2.277397
other
Bi2Te2Cl2
6
186
208.02
mp-1042832
8.93837
13.425726
-1.391804
other
Zn4Cr6O16
26
186
285.01
mp-1042523
10.497153
11.684762
2.638427
other
Ca4Ti6O16
26
186
341.4
mp-20290
-7.782367
-6.63154
3.865852
other
Tb2Cu2Pb2
6
186
134.53
mp-19241
6.06445
11.458171
-0.38704
other
Ba2Ni2O6
10
186
133.53
mp-867653
7.240976
12.991709
-2.20761
other
Co6Te2O16
24
186
253.75
mp-754103
6.022898
11.547099
-1.009238
other
Ca2Ni2O6
10
186
111.93
mp-31132
8.448322
2.003881
-0.132403
other
Hg8O2F12
22
186
318.34
mp-568485
-7.956627
-6.641203
6.83182
other
Nd46Mg8Rh14
68
186
1,997.49
mp-1207700
-7.859138
-2.325461
3.706304
other
Yb6Co16Sn8
30
186
512.46
mp-6917
-7.946809
-6.363913
3.610765
other
Tm2Ag2Sn2
6
186
138.27
mp-1006328
-6.852637
-5.917697
3.943181
other
Li8Ce8Sn8
24
186
595.07
mp-9387
-7.931184
-4.410029
4.678323
other
Tb2Cu2Ge2
6
186
113.93
mp-771290
8.508488
14.92466
-0.982772
other
Li4Mn8O16
28
186
290.97
mp-1197990
-8.200808
-6.829507
7.144682
other
Pr46Cd8Ru14
68
186
1,976.23
mp-756455
11.487529
13.254493
0.595291
other
Ti6V2O16
24
186
276.26
mp-21436
-7.91187
-5.356198
3.412652
other
Gd2Cu2Sn2
6
186
131.84
mp-1101280
6.485327
13.268405
-2.354924
other
Ti2Co6O16
24
186
245.65
mp-755546
9.871161
8.777892
0.348288
other
Na12Be2O8
22
186
267.27
mp-1205336
6.814638
11.879504
1.38057
other
Ba4Mn4O12
20
186
276.81
mp-1214816
-1.595987
0.346772
2.452897
other
Al8Si2C8
18
186
204.94
mp-567446
-7.680836
-6.229649
6.046458
other
La46Cd8Pt14
68
186
2,129.79
mp-15839
-6.558895
-4.03905
0.819795
other
Nd2Sb2Pt2
6
186
146.31
mp-9351
-8.670759
-6.213671
3.215174
original
Lu2Ge2Au2
6
186
118.85
mp-1192210
-7.146449
-6.310835
4.454632
other
Li8Dy8Sn8
24
186
557.53
mp-1208089
-7.772529
-2.348633
3.496032
other
Tm6Co16Sn8
30
186
501.32
mp-17824
12.679555
11.229218
-1.434255
other
Co4Mo6O16
26
186
299.17
mp-1192259
-7.831826
-6.605918
6.654398
other
Nd16Ga6Co2
24
186
663.46
mp-1042732
5.49654
10.678313
-1.879114
other
Mg4Fe6O16
26
186
287.95
mp-1245901
2.044292
2.427674
1.129406
other
Rb2Sn2N2
6
186
136.58
mp-1025128
-7.711354
-6.597533
3.835312
other
La2Cu2Pb2
6
186
152.37