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-510582
2.68886
-0.549643
-1.71195
other
Nd2Ni2Sn2H4
10
194
142.17
mp-6185
4.237992
2.287874
-3.277386
other
Er2Co2C12N12
28
194
617.05
mp-17137
7.562104
10.689932
1.259716
other
Ba6Zn2Ru4O18
30
194
429.4
mp-559378
9.592603
9.974506
3.262695
other
Ba10Ta4Cl4O18
36
194
794.41
mp-556391
-5.139982
-6.292844
1.387901
other
Ba4Mn4Bi4O2
14
194
425.05
mp-6077
8.142776
10.453201
1.520283
other
Ba6Sm2Ru4O18
30
194
460.27
mp-1212837
-3.330601
-4.106616
0.742491
other
Eu4Zn4Cu2P6
16
194
318.25
mp-22352
8.075552
10.555073
1.29278
other
Ba6In2Ru4O18
30
194
437.56
mp-851087
11.213253
0.947879
0.705741
other
Li4Fe4O4F8
20
194
228.38
mp-558624
8.195662
10.435654
1.520773
other
Ba6La2Ru4O18
30
194
460.7
mp-540794
10.043735
10.138315
3.350984
other
Ba6Sr2Nb4O18
30
194
519.24
mp-1214916
7.579696
10.445692
0.849819
other
Ba6In2Ir4O18
30
194
446.56
mp-541811
-4.73167
-6.196143
0.649354
other
Cs12K6Ga2Sb8
28
194
1,264.26
mp-1209462
10.038053
10.965109
-2.315236
other
Rb6Na2Re4O18
30
194
495.7
mp-561170
8.800338
10.644188
1.5119
other
Ba6Zr2Ru4O18
30
194
433.8
mp-1189912
7.994841
4.836655
-6.048525
other
Pu2C2N2O10
16
194
241.7
mp-541743
7.678407
10.562262
1.262349
other
Ba6Yb2Ru4O18
30
194
445.41
mp-541707
-4.940488
-6.19868
0.649328
other
K12Na6Al2Sb8
28
194
971.94
mp-6018
8.192425
10.43901
1.510038
other
Ba6Nd2Ru4O18
30
194
466.7
mp-862693
3.336813
-0.719784
-2.428117
other
Ba2Na2H6Pd2
12
194
199.43
mp-561413
8.297446
1.206116
0.479743
other
Rb4Tb6Al2F32
44
194
651.25
mp-1227420
6.653112
11.99629
1.43249
other
Ba2Sr2Mn4O12
20
194
256.08
mp-1197979
-3.858683
-0.334362
2.9283
other
Ti24Al2Si6C16
48
194
588.6
mp-9793
10.458443
8.288299
1.718153
other
Ba6B2As2O6
16
194
380.61
mp-1194133
4.199121
2.290441
-3.275091
other
Pr2Co2C12N12
28
194
673.78
mp-1192668
13.61381
9.492622
-1.168081
other
K2V6Ge4O18
30
194
428.65
mp-1222463
9.519622
10.649055
1.110949
other
Lu2Zn8Fe2O14
26
194
324.95
mp-556259
7.902036
10.453504
1.352947
other
Ba6Eu2Ru4O18
30
194
460.37
mp-6345
8.048742
10.468023
1.547125
other
Ba6Tb2Ru4O18
30
194
451.38
mp-6443
7.750679
10.503166
1.349961
other
Ba6Ca2Ru4O18
30
194
461.1
mp-6520
7.447436
10.628063
1.262003
other
Ba6Mg2Ru4O18
30
194
419.45
mp-542208
8.076972
10.423506
1.127964
other
Ba6Na2Os4O18
30
194
435.81
mp-19058
7.511766
10.859686
1.13009
other
Ba6Co2Ru4O18
30
194
416.66
mp-556443
7.818532
10.374796
1.408298
other
Ba10Ru4Cl4O18
36
194
743.07
mp-561147
7.897066
10.330382
1.193562
other
Ba8Bi4Ru4O24
40
194
671.42
mp-17269
9.412996
9.347077
1.008364
other
Ba12Ni4Sb8O36
60
194
888.84
mp-1210152
12.971592
10.696301
1.985901
other
Na2Nb14V4O28
48
194
578.98
mp-557902
11.405475
11.073539
-3.849741
other
K6Mo4Br2O14
26
194
522.87
mp-1187872
10.814965
8.680408
-0.13799
other
Zn4In2Ga2O10
18
194
220.55
mp-669391
-3.491178
-4.257966
0.769144
other
Ca8Zn4Cu6P10
28
194
527.63
mp-1201626
-5.501476
-0.304202
3.366306
other
Al6Co2W18C6
32
194
429.61
mp-1214637
7.303605
10.622226
0.681542
other
Ba6Co2Ir4O18
30
194
429.05
mp-1214487
9.383797
9.337259
1.140954
other
Ba6Zn2Sb4O18
30
194
449.29
mp-568508
1.516014
2.711946
-5.837259
other
Cs8Rb8Mn16Cl48
80
194
2,176.31
mp-542207
8.01542
10.489737
1.164779
other
Ba6Li2Os4O18
30
194
416.93
mp-1214518
-4.925246
-6.502028
1.790344
other
Ba6Sr6Bi4N4
20
194
646.59
mp-562523
11.161692
10.951797
-3.425224
other
Cs6Mo4O12F6
28
194
580.88
mp-9712
10.376941
8.841319
1.491327
other
Ba6B2P2O6
16
194
369
mp-558725
7.804982
10.250839
1.335766
other
Ba10Ru4Br4O18
36
194
791.37
mp-1096783
7.078229
11.487315
0.815245
other
Ba8V4Fe4O24
40
194
534.01
mp-19337
9.399508
9.415542
1.165956
other
Ba12Co4Sb8O36
60
194
898.98
mp-720712
8.729406
1.065769
-4.064323
other
Cr4H48I6N18
76
194
955.06
mp-540692
7.233974
8.674353
-1.654271
other
Ba6Sm2Ir4O18
30
194
642.51
mp-1182400
7.590794
10.360787
1.090937
other
Ba6La2Ir4O18
30
194
476.96
mp-6112
-4.935046
-6.210813
0.630799
other
K12Na6Ga2Sb8
28
194
972.55
mp-16978
9.366105
9.306305
1.308111
other
Ba6Mg2Sb4O18
30
194
446.99
mp-554909
7.290575
10.537751
0.868089
other
Ba6Mg2Ir4O18
30
194
427.14
mp-1214509
8.032407
10.371485
1.167967
other
Ba6Zr2Ir4O18
30
194
436.19
mp-542122
7.224878
10.583798
0.920154
other
Ba6Li2Ru4O18
30
194
429.19
mp-1214536
8.089538
10.46137
1.554054
other
Ba6Ho2Ru4O18
30
194
447.61
mp-541721
8.128927
10.481661
1.567819
other
Ba6Er2Ru4O18
30
194
444.42
mp-1153970
10.565428
9.01587
0.04097
other
Zn8In2Ga2O14
26
194
320.29
mp-16821
8.148885
10.445618
1.53442
other
Ba6Pr2Ru4O18
30
194
470.84
mp-561099
8.312891
10.849001
0.536373
other
Ba4Os6Cl1O18
29
197
427.02
mp-1193929
7.814763
11.210881
0.2683
other
Sr4Ru6Cl1O18
29
197
409.26
mp-1224221
10.368414
7.26724
-5.823596
other
K7Be12P12O48
79
197
1,235.6
mp-556428
8.746001
10.481669
1.194337
other
Ba6Fe4Br4O10
24
199
535.1
mp-1201205
7.678706
0.694749
-4.042371
other
Li16B4H40N12
72
199
618.98
mp-560330
8.234847
10.545657
0.968622
other
Ba6Fe4Cl4O10
24
199
520.73
mp-866635
8.739947
1.034296
-4.231599
other
Cu4H12N4Cl4
24
199
291.72
mp-555730
8.85278
0.987266
1.524757
other
Na4Ca6Al4F28
42
199
557.99
mp-1226601
9.232822
12.09991
-1.588863
other
Co6Cu6Te4O24
40
199
457.34
mp-778808
10.623489
10.163517
3.076174
other
Li24La12Nb8O48
92
199
1,072.16
mp-643579
9.135383
2.202849
-1.818989
other
Sb4H12O4F24
44
199
534.83
mp-727270
8.871077
7.879122
-4.244012
other
Zn16As12N4O52
84
199
1,384.89
mp-1229183
-4.146222
-1.771409
-5.08677
other
Ag12Au4Se4S4
24
199
500.55
mp-640715
9.454318
7.400496
-4.995836
other
Rb24Yb16P24O96
160
199
2,660.89
mp-866617
8.608012
3.675097
-7.0714
other
Cs4Sr4C6O18
32
199
526.63
mp-558539
8.555815
3.714335
-6.993683
other
Cs4Ba4C6O18
32
199
581.59
mp-1216878
-6.204238
-3.816361
1.933258
other
U6Ni6Sn4Sb4
20
199
402.49
mp-1215702
9.299492
11.223882
-1.485583
other
Zn6Cu6Te4O24
40
199
459.7
mp-984332
8.6251
3.664445
-7.097386
other
Rb4Sr4C6O18
32
199
491.73
mp-757471
12.839098
7.413683
-1.457365
other
Li8V4Si12O36
60
19
803.17
mp-1228693
1.184708
2.069725
1.457744
other
Ba12Ca12Mo8N32
64
19
1,196.87
mp-1197256
11.178413
6.908356
-1.625059
other
K8Ti4Si12O40
64
19
937.26
mp-707765
10.019689
3.092409
-3.899417
other
Te4H48Cl16O24
92
19
1,138.08
mp-541281
9.619068
8.484179
2.282814
other
Ba4Nd4Ga4O16
28
19
426.62
mp-1373701
10.401626
7.644331
-4.967872
other
Ca4Co4As4O20
32
19
397.89
mp-561539
10.278833
4.499104
-7.26725
other
K8Mn8S12O48
76
19
1,075.81
mp-765589
10.355359
2.123634
1.071433
other
Li8V4O4F16
32
19
377.04
mp-14469
12.79438
6.557028
-6.445766
other
K4Hg4P12O36
56
19
835.03
mp-726002
7.122735
6.551634
-3.556994
other
K8I12N4O48
72
19
1,236.63
mp-505785
11.282397
4.424428
-4.737993
other
Cu4P4H20O20
48
19
452.56
mp-601265
9.058525
4.277583
-4.508317
other
Sr4H24C8O24
60
19
727.95
mp-1220185
-2.842416
-2.728618
-4.624533
other
Nd4Th4U4S20
32
19
724.09
mp-1020159
9.616914
4.771418
-6.441362
other
Na8Si4S24O84
120
19
1,859.63
mp-1044935
13.374148
7.251927
-5.476575
other
Zn4Sb8P8O36
56
19
853.72
mp-559984
8.028954
7.921635
-0.504483
other
Rb32Al4Au12O16
64
19
1,883.25
mp-1237207
9.245936
3.248126
-5.099341
other
Sr4H24C8O24
60
19
657.66
mp-556966
10.952369
12.0346
-3.169995
other
K4Sr4V4O16
28
19
452.56