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-7180
-7.424652
-4.188135
3.497916
other
U4Ge4Au4
12
194
260.04
mp-9631
12.410527
8.036315
0.165399
other
Al2Ag2O4
8
194
87.86
mp-1079847
-0.748845
1.235765
-4.511546
other
Cs2Fe2Br6
10
194
309.1
mp-19835
-4.351306
-0.859935
3.037293
other
Nb4In2C2
8
194
127.68
mp-1025524
-3.375669
-1.372747
2.875498
other
Zr4Tl2C2
8
194
148.38
mp-772199
-0.221709
2.431874
-4.202769
other
Rb18Cl6O6
30
194
1,025.75
mp-556488
9.041059
0.583117
0.5203
other
Rb6Ni6F18
30
194
420.46
mp-1077418
-5.770576
-3.949393
1.14294
other
U2Sb2Pd2
6
194
137.65
mp-3405
12.551641
7.50204
0.571584
other
Na2Al22O34
58
194
610.4
mp-1212415
-8.454488
-4.522637
4.440155
other
Ho6Cu22Si8
36
194
526.22
mp-624214
-1.241113
2.847959
-2.935676
other
Cs6Bi4I18
28
194
1,366.15
mp-1102059
-7.217093
-0.416319
5.196886
other
Zr4Ga2Fe6
12
194
180.06
mp-1096793
-4.196635
-1.422598
-6.011877
other
Al4Zn4S10
18
194
355.63
mp-1216783
-6.708147
-0.49156
4.541949
other
U4Fe6Si2
12
194
165.54
mp-5025
-2.78239
-0.982348
0.722921
other
Zr4C2S2
8
194
124.01
mp-562506
6.733453
13.328428
-2.028825
other
Sr2Co24O38
64
194
651.67
mp-1212927
-8.549464
-4.550474
4.417936
other
Er6Cu22Si8
36
194
525.77
mp-9573
-4.577882
-5.14252
0.429987
other
Na2Be2As2
6
194
111.66
mp-1191705
-5.117604
-3.777394
5.907105
other
Er8Si12Rh4
24
194
452.31
mp-1092248
-8.239081
-4.166922
3.430602
other
Tb2In2Pt4
8
194
162.17
mp-1213915
-8.485048
-0.833673
4.903579
other
Ce6Zn6Co12
24
194
367.51
mp-1213221
-8.305431
-2.72281
4.36164
other
Er6Ge6Rh12
24
194
405.77
mp-1080474
2.462064
2.939622
-4.220944
other
Fe2N2Cl6
10
194
225.7
mp-1077392
-7.960664
-4.417608
4.717095
other
Tm2Cu2Ge2
6
194
109.12
mp-1222088
-9.077203
-4.073661
3.413444
other
Mn4Cu6Ge2
12
194
161.4
mp-20917
-7.26234
-0.819988
5.18145
other
U4Fe6Ge2
12
194
186.68
mp-1212073
-7.106073
-4.554302
5.485182
other
Ho4Zn4Ge4
12
194
236.36
mp-1406914
12.218806
9.58217
0.406336
other
Al2Sn2O6
10
194
127.22
mp-1102150
-6.118889
-3.559948
0.752947
other
Lu4As4Pt4
12
194
238.3
mp-1400236
12.633008
10.236558
0.499554
other
Al2W2O6
10
194
120.07
mp-1018755
-7.522337
-7.14683
5.247591
other
La2Tl2Zn2
6
194
159.89
mp-1201385
8.894266
13.144723
-1.043999
other
Ba6Fe52O82
140
194
1,661.2
mp-1207947
-6.888867
-4.592028
5.516528
other
Tm4Zn4Ge4
12
194
231.44
mp-31140
-5.579511
-6.179108
0.940859
other
Ba2Bi2Au2
6
194
200.45
mp-3202
-6.001431
-1.238924
0.943798
other
Ba2Ni18P10
30
194
391.91
mp-22991
-1.266046
2.695981
-2.64685
other
Cs2V2I6
10
194
407.91
mp-14623
-4.479956
-5.739538
0.505552
other
K10Cu2As4
16
194
533.85
mp-9987
-4.078434
-0.715878
2.801004
other
Nb4P2C2
8
194
110.61
mp-29458
1.504704
2.931501
-5.16543
other
Rb6Mo4Cl18
28
194
779.27
mp-1078849
-3.491822
-4.349194
0.640751
other
Ca2Ga4P4
10
194
209.53
mp-1206457
-7.260834
-0.391509
3.883183
other
Mn2In2Fe2
6
194
95.34
mp-1387900
10.532189
10.845433
1.72571
other
Y2Cr2O6
10
194
124.59
mp-9586
-3.825617
-0.270521
-3.941695
other
Nb2Sn2S4
8
194
170.66
mp-891774
10.541472
13.470383
-1.294558
other
Na2Cr12O22
36
194
381.88
mp-755128
9.842455
8.551464
2.497281
other
Sm2Tl2O4
8
194
146.52
mp-19271
7.874649
11.426485
1.015656
other
Ba4Cr4O12
20
194
270.67
mp-1193442
-6.19258
-3.181734
4.123468
other
Zr18Re8B2
28
194
544.26
mp-1205652
1.386455
2.535072
-5.359199
other
Tl2Ni2Cl6
10
194
238.93
mp-1246664
0.010524
2.431007
2.073217
other
Cr2Fe6N6
14
194
148.26
mp-1193638
-4.595349
-0.955902
-2.906083
other
Nb8Fe2Se16
26
194
545.62
mp-972049
-1.929783
0.469045
2.434446
other
Tb2Al6C6
14
194
175.66
mp-29076
0.100271
2.232306
2.289849
other
Fe2W2N4
8
194
79.87
mp-1232379
-3.265125
0.80632
2.901566
other
Y2B2C2
6
194
64.22
mp-1215536
-5.811356
-1.747509
3.925767
other
Zr4Si2Mo6
12
194
211.68
mp-1206094
-5.806137
-1.023132
2.114369
other
Co2P4W2
8
194
106.29
mp-35143
-3.150354
-1.213556
-4.862063
other
Ba2Nb2S6
10
194
240.12
mp-1025029
-0.687165
-2.030491
-3.482269
other
Pr2H2Se2
6
194
114.39
mp-1024955
-6.123619
-4.163358
0.871192
other
Pr2Ni2Sb2
6
194
138.62
mp-9898
-4.853334
-5.070549
0.84556
other
Ba2Cu2As2
6
194
152.01
mp-1018688
-7.601032
-7.23835
5.527256
other
Er2Tl2Zn2
6
194
137.49
mp-20231
-8.402312
-5.023034
3.292264
other
Ce2In2Pd4
8
194
170.82
mp-12990
-4.242111
-0.579254
3.096402
other
Ti4Al2C2
8
194
110.8
mp-23378
-6.168265
-6.188776
0.957236
other
Eu2Ag2Bi2
6
194
172.74
mp-10746
-8.473694
-4.35701
4.290449
other
Mg4Cu6Si2
12
194
167.08
mp-1215610
-6.180259
-1.958573
4.195099
other
Zr4V6Si2
12
194
197.41
mp-1197720
-7.593029
0.681058
5.083318
other
Tm4Ga6Fe28
38
194
518.05
mp-1025497
-5.082934
-0.027491
3.031694
other
Al2V4C2
8
194
94.63
mp-27707
1.599125
2.699784
-5.633601
other
Rb2Co2Cl6
10
194
253.43
mp-1207783
-8.428049
-7.157337
5.191177
other
Y8Mg12Zn16
36
194
743.28
mp-1188187
-6.553117
-6.504307
2.59705
other
Li6Zn4Sn8
18
194
388.1
mp-28282
1.274921
2.071529
-4.625329
other
Rb2Ti2Cl6
10
194
258.41
mp-556690
8.794606
2.326063
1.942309
other
Cs2U12F50
64
194
975.92
mp-27319
-7.839076
-1.153738
4.849367
other
Sc4Co6Si2
12
194
159.73
mp-1213053
-7.401345
-6.043846
4.457438
other
Dy4Zn4Sn4
12
194
275.3
mp-1216413
-6.596264
-1.958621
1.712218
other
V2Co2Sb2
6
194
91.31
mp-1402500
12.06038
10.888454
0.91009
other
Y2V2O6
10
194
132.72
mp-1208090
-7.735906
0.683327
4.719853
other
Tm4Fe34H6
44
194
514.98
mp-21204
-5.141885
-2.334528
1.891304
other
Zr2Ni2P2
6
194
92.86
mp-1018729
-8.213452
-6.344231
5.501869
other
Ho2Zn2In2
6
194
132.92
mp-1222187
-9.231392
-4.586365
3.92186
other
Mg4Cu6Ge2
12
194
173.34
mp-1102160
-6.498331
-6.723032
3.242462
other
Eu4Ga4Sn4
12
194
321.6
mp-1077167
-7.987812
-5.386847
3.409172
other
Tm2Cu2Sn2
6
194
125.24
mp-1238820
-3.979493
0.537497
2.812069
other
Ta2B2C2
6
194
54.78
mp-4893
-3.403344
-0.319444
2.816681
original
Hf4Sn2C2
8
194
138.18
mp-3598
8.334904
10.661419
1.217875
other
Ba6Ru6O18
30
194
415.02
mp-12814
-4.572992
-6.30054
1.821484
other
Ba6Sb2N2
10
194
339.62
mp-1213200
-7.240628
-2.174071
6.26692
other
Dy6Al24Os8
38
194
634.42
mp-20237
-7.634816
-1.840885
2.542363
other
Co2Ni2Sn2
6
194
83.15
mp-1207199
-5.946363
-3.984641
0.571749
other
Pr2As2Pd2
6
194
131.25
mp-1211229
-3.305551
-3.860585
0.740664
other
La2Zn6P6
14
194
286.57
mp-1103143
-6.090839
-3.549406
0.790263
other
Sm4As4Pt4
12
194
252.61
mp-1384488
12.60006
12.22605
-0.488416
other
Al2V2O6
10
194
105.45
mp-1207814
-7.210034
-2.226046
6.267496
other
Y6Al24Os8
38
194
636.51
mp-1220766
-6.784775
-0.706279
3.970108
other
Nb4Fe2Co6
12
194
153.38
mp-1246377
1.032117
2.475647
1.733371
other
Ca2Mn2N4
8
194
87.95
mp-28911
3.312659
-0.761075
-2.227459
other
Ba2Re2H18
22
194
229.13
mp-1077348
-8.26422
-5.551769
4.353214
other
Ce2In2Cu2
6
194
131.02
mp-1384267
12.087613
9.930874
0.610917
other
Al2Sb2O6
10
194
136.03
mp-569568
-4.258111
-0.482145
3.062166
other
Ta6Al2C4
12
194
158.79
mp-1201787
-8.738064
-1.899985
2.885735
other
Lu4Ga10Ni24
38
194
504.49