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-10366
-6.48409
-1.129022
3.849375
other
Nb4Co6Si2
12
194
151.9
mp-10677
-4.046003
-4.283955
0.685593
other
Ca2P2Au2
6
194
125.02
mp-1208806
-6.099819
-10.558235
5.527818
other
Sr8Mg12Al4
24
194
701.16
mp-10667
-3.579756
-4.55955
0.761624
other
Sr2Ag2P2
6
194
140.08
mp-4538
-3.866679
-0.227315
-3.804132
other
Ta2Sn2S4
8
194
168.44
mp-1208710
-5.635099
-6.810722
4.648417
other
Sr8Mg6Al10
24
194
631.59
mp-3570
-5.0665
-3.45035
0.921226
other
Nd2P2Pd2
6
194
121.27
mp-22144
-4.360334
-0.496976
3.168239
other
Ta4In2C2
8
194
126.28
mp-1102307
-6.502824
-1.873786
4.133719
other
Zr4V6Ru2
12
194
197.93
mp-1178335
11.35457
9.040444
-0.80883
other
Ga2Pt2O4
8
194
93.32
mp-1215662
-7.105127
-0.437376
5.015873
other
Zr4Cr2Fe6
12
194
173.56
mp-20042
-3.868542
-1.626565
-5.592978
other
Tl2In2S4
8
194
193.61
mp-1071862
-7.642846
-5.599461
6.10313
other
Y2Al2Zn2
6
194
123.81
mp-13007
-6.972499
-3.848808
5.416397
other
Pr2Cr2Ge6
10
194
190.68
mp-569753
1.582649
2.592995
-5.479319
other
Tl2Co2Cl6
10
194
243.61
mp-1207692
-3.288547
-3.872819
0.760056
other
Y2Zn6P6
14
194
270.5
mp-1206241
-8.220889
-4.09055
3.399159
other
Ho2In2Pt4
8
194
165.45
mp-1018681
-8.203933
-6.392375
5.564844
other
Dy2Zn2In2
6
194
134.39
mp-504708
1.630595
2.830924
-5.861101
other
Cs2Co2Cl6
10
194
273.03
mp-1237224
-6.495041
-1.509321
4.687108
other
Zr2Al2Cr6
10
194
159.14
mp-4120
-5.169041
-4.652479
0.669775
other
Ca2Cu2As2
6
194
119.32
mp-1206169
-4.36328
-5.138515
5.258399
other
Sr2Cu2Si2
6
194
135.59
mp-542933
-9.596867
-4.61981
3.931278
other
Tb2Mg4Cu18
24
194
341.51
mp-1224364
-7.394836
-1.996191
3.605542
other
Hf4Si2Ni6
12
194
167.88
mp-1224546
-5.809715
-3.244653
4.025321
other
Hf18B4Mo6
28
194
516.15
mp-23038
-0.75948
1.046827
-4.423627
other
Cs2V2Br6
10
194
326.2
mp-1246809
0.574866
2.303322
1.810548
other
Ni2Os2N4
8
194
86.34
mp-1210620
8.344536
2.413893
2.545548
other
Lu4Se4F4
12
194
245.92
mp-1224435
-6.597108
-1.742735
4.246485
other
Hf4V6Ru2
12
194
193.09
mp-1214838
-6.551565
-2.17735
6.151884
other
Al18Cr6Si2
26
194
374.02
mp-1096841
-4.04094
-3.650172
1.040189
other
Ba2Mo2P4
8
194
173.39
mp-1218039
-6.796345
-1.725125
3.30408
other
Ta4Si2Ni6
12
194
156.42
mp-1206320
1.020397
1.7272
-4.788002
other
Rb2Sc2Cl6
10
194
273.09
mp-1213248
-7.774074
0.714201
4.750926
other
Dy4Fe34H6
44
194
522.19
mp-4978
0.697048
1.194128
2.848474
other
Ti4Al2N2
8
194
104.78
mp-1218041
-7.848694
-1.546632
2.595806
other
Ta2Al2Ni12
16
194
183.1
mp-12846
-6.600863
-5.592916
4.098821
other
Yb4Ga4Ge4
12
194
259.32
mp-22702
-7.760751
-0.827718
3.564294
other
Mn4Co6Ge2
12
194
151.73
mp-29750
-0.378444
1.33493
-4.76334
other
Cs2Mg2Br6
10
194
329.79
mp-1207156
-8.207614
-4.687733
3.637559
other
Li2In2Rh2
6
194
93.11
mp-510441
-8.216805
-4.18079
3.456439
other
Y2In2Pt4
8
194
161.88
mp-19821
-5.050666
0.148809
3.067708
other
Cr4Ge2C2
8
194
94.09
mp-30042
-6.331193
-5.802845
4.290566
other
Li4Ce2Ge2
8
194
147.49
mp-1212484
-7.663729
1.014321
4.725662
other
Ho4Fe34C6
44
194
537.1
mp-1192886
8.511222
1.852335
-1.247142
other
Ni6N6F18
30
194
372.41
mp-1210999
-8.785942
-2.035764
3.445982
other
Lu6Ga6Ni12
24
194
349.56
mp-28170
-9.275934
-0.774876
2.749506
other
Ca10Ni30B8
48
194
623.08
mp-23738
3.401902
-0.627836
-2.562591
other
Rb6Mg6H18
30
194
428.67
mp-1095550
-6.208474
-3.55537
0.767684
other
Ho4As4Pt4
12
194
238.67
mp-1025449
-8.23542
-4.10815
3.413905
other
Tb2In2Pt4
8
194
167.27
mp-754226
9.98749
8.446092
3.182061
other
Y2Lu2O6
10
194
148.49
mp-16924
12.78666
12.803294
-0.95654
other
Sr2V12O22
36
194
405.83
mp-1212925
-7.382226
-2.194273
6.09691
other
Er6Al24Ru8
38
194
625.54
mp-1208368
-7.674392
-1.41503
5.91603
other
Tb2Ga2Fe2
6
194
113.33
mp-20201
-7.579458
-6.164003
4.526409
other
Nd4Zn4Sn4
12
194
297.7
mp-567727
-1.477805
0.939232
-1.07724
original
Pr4Co4I2
10
194
255.5
mp-21373
-3.565759
-4.226794
0.73873
other
Eu2Cu2P2
6
194
117.13
mp-10371
-0.031908
2.018106
2.195711
other
Cr4Ga2N2
8
194
91.44
mp-1197659
-7.556522
0.692596
5.027357
other
Dy4Nb4Fe30
38
194
529.31
mp-10900
-6.901781
-3.022424
5.181743
other
U4Al6Os2
12
194
219.89
mp-550807
8.836736
14.005908
-0.629246
other
Mn2In2O6
10
194
122.77
mp-6954
-4.986287
-5.347235
0.559261
other
Sr2Ag2As2
6
194
149.59
mp-1208849
-7.107405
-4.662276
5.51823
other
Sm4Zn4Ge4
12
194
252.75
mp-23486
1.436791
2.69119
-5.446593
other
Rb2Ni2Cl6
10
194
247.98
mp-21023
-3.847982
-0.339959
3.018909
other
Ti6Sn2C4
12
194
159.5
mp-1076951
-7.462914
-4.195921
4.798345
other
Ce2Ni2Ge2
6
194
114.77
mp-13227
-9.541324
-4.619574
3.835919
other
Yb2Mg4Cu18
24
194
347.45
mp-17168
-9.16945
-0.762297
2.828547
other
Er6Ni14B4
24
194
306.5
mp-1025087
-6.198451
-4.160925
0.908005
other
Nd2Ni2Sb2
6
194
136.2
mp-754055
9.748722
8.264612
2.174873
other
Cs2Er2O4
8
194
144.11
mp-5306
-4.126964
-0.053423
-3.78729
other
Nb8Cr2S16
26
194
471.07
mp-28234
12.453608
7.577124
0.50557
other
Ca2Al24O38
64
194
602.27
mp-1018896
-8.454603
-6.782705
3.28844
other
Pr2Pb2Au2
6
194
162.55
mp-669308
-1.328472
2.579206
-2.284557
other
Cs6Tm4I18
28
194
1,328.08
mp-1005955
-9.16422
-0.718285
2.842831
other
Tm6Ni14B4
24
194
311.68
mp-20743
-8.521767
-5.096299
3.383216
other
La2In2Pd4
8
194
176.92
mp-7438
-5.137593
-5.866477
0.464123
other
K2Zn2Sb2
6
194
187.32
mp-1221815
-6.252923
-0.568303
3.653582
other
Mn6Si2W4
12
194
151.84
mp-10797
-7.66344
-2.261512
3.764807
other
Ca2Si2Ni4
8
194
133.92
mp-1072802
-6.36623
-6.674881
3.194644
other
Ca2Zn2Sn2
6
194
151.5
mp-1094100
-4.086444
-0.052126
-3.720862
other
Nb8Co2S16
26
194
468.89
mp-976584
-5.943264
-3.035218
3.957364
other
Hf18Mo8As2
28
194
560.4
mp-1220738
-6.988198
-1.844418
3.256994
other
Nb4Ga2Ni6
12
194
163.15
mp-1104636
-1.923316
0.465263
2.381736
other
Er2Al6C6
14
194
171.96
mp-1019279
-6.279005
-6.733859
3.223154
other
Sr2Zn2Sn2
6
194
169.41
mp-1191126
-8.472874
-0.535569
4.90352
other
Ce6Co16Si2
24
194
339.65
mp-1210936
9.622397
11.671674
0.781132
other
Lu4Fe6O14
24
194
299.87
mp-1193665
-6.620198
-2.833998
4.411178
other
Hf18B2Os8
28
194
521.17
mp-1247332
1.220734
2.402563
1.96914
other
Mg6Cr2N6
14
194
180.42
mp-1246433
4.314256
2.211797
-3.196777
other
Cr4C12N12
28
194
523.84
mp-571493
-7.116787
-7.318164
3.214183
other
Yb2Hg2Pb2
6
194
167.91
mp-1019087
-6.828727
-7.100397
2.740754
other
Ca2Sn2Hg2
6
194
166
mp-1200461
-8.847466
-1.717174
2.942906
other
Lu4Ga6Ni28
38
194
484.05
mp-1183832
-6.105515
-2.911977
1.355382
other
Ce2As2Rh2
6
194
120.86
mp-1192283
-9.150749
-1.588437
3.016354
other
Dy6Al2Ni16
24
194
354.32
mp-12325
-4.796724
-3.467698
-3.753364
other
Cs2Yb2Se4
8
194
276.97
mp-1213039
-3.308562
-3.898231
0.734611
other
Dy2Zn6P6
14
194
269.61
mp-1220878
-3.953541
-0.43585
-4.685807
other
Na2Ti2S4
8
194
174.73
mp-1206598
2.040561
1.717424
1.666348
original
Ba2Th2N4
8
194
158.32
mp-1217775
-6.496118
-1.114446
3.80242
other
Ta4Co6Si2
12
194
150.02