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-1203252
7.390979
7.02728
-3.477622
other
Ag8I4O20
32
14
465.36
mp-28761
7.090451
11.866637
1.811278
other
Sr14Mn8O30
52
14
680.34
mp-30971
-5.520148
-2.754221
-2.465156
other
Cu4Te8Cl4
16
14
457.97
mp-1221690
-4.849551
-2.471936
-3.881616
other
Mn2Cd2Se8
12
14
284.87
mp-727242
7.793004
5.4561
-5.9063
other
Na4C4O12
20
14
247.23
mp-754645
3.184682
3.351411
-4.517342
other
Mg4Cl8O4
16
14
385.35
mp-729142
7.826423
4.979287
-6.034143
other
Ca8C16O40
64
14
886.69
mp-758606
10.007906
2.262621
0.624447
other
Li4V4F20
28
14
344.72
mp-770413
9.743319
8.344658
3.166245
other
La4Ho4O12
20
14
312.48
mp-728442
8.209197
7.140115
-4.644396
other
Zr4As8O36
48
14
832.19
mp-1209622
13.174137
7.707377
-3.535168
other
Pu4As4O16
24
14
327.98
mp-28983
-0.462614
1.215248
-4.218281
other
Pd2Pb4Br12
18
14
544.91
mp-560489
7.623341
6.602697
-3.105007
other
Gd4I12O36
52
14
792.66
mp-18433
10.483306
10.576661
3.39858
other
Nd4Ta4O16
24
14
317.84
mp-542837
10.851417
11.237694
-1.782722
other
Ba8W8O32
48
14
749.04
mp-1199255
6.367244
0.304565
-3.439517
other
B40H52I4
96
14
1,226.38
mp-725061
4.697311
3.049651
-3.754132
other
C4S4N8
16
14
497.47
mp-1189476
7.884043
11.863878
2.147574
other
Nd4Mn4O12
20
14
245.81
mp-1198370
-5.101528
-6.346016
3.389231
other
Ca44Sn12C32
88
14
1,953.36
mp-542662
1.644038
2.424679
-4.830834
other
Ga8Te8Cl28
44
14
1,390.43
mp-21016
10.446023
8.08298
-4.82864
other
Fe4As4O16
24
14
300.76
mp-26324
13.712391
8.680748
-5.396005
other
Mo4P8O28
40
14
559.31
mp-1182665
-6.31027
-5.653152
4.062591
other
Li4Yb32Ge52
88
14
2,081.23
mp-1214474
9.975224
0.944551
1.330919
other
Ba4Fe8F28
40
14
537.89
mp-1212327
10.766151
8.182283
2.398082
other
Ho16Al8O36
60
14
828.75
mp-1198796
8.424114
1.37643
1.185232
other
Rb16Sn16F48
80
14
1,776.24
mp-1180644
6.564825
8.511014
-2.715307
other
Li4Sn2O12
18
14
212.62
mp-734378
12.112533
7.580738
-6.945584
other
Ni8P8O28
44
14
467.67
mp-1047608
8.29954
8.051912
-4.526291
other
Co6As8O32
46
14
639.88
mp-1194611
-5.726733
-3.50185
-1.230921
other
Ba4U4Te24
32
14
1,142.26
mp-28204
10.704361
3.529761
-3.922343
other
Cs4H28O16
48
14
498.19
mp-753824
10.076394
1.498909
1.78411
other
Li8Cr2F12
22
14
230.17
mp-1020124
12.878136
6.654531
-0.628992
other
Mg16Si16O48
80
14
874.87
mp-685798
-6.335987
-6.028787
3.897735
other
Yb28Mg12Ge32
72
14
1,751.55
mp-1180135
10.056961
0.525624
0.305479
other
Mn4Cd4F20
28
14
417.89
mp-28150
10.55363
11.416808
3.215762
other
Ba2Nb4O12
18
14
262.93
mp-649334
2.105266
2.820027
-4.400587
other
Fe4S4Cl28
36
14
1,071.65
mp-684018
13.831641
4.218136
-2.391454
other
Sr8B64O104
176
14
1,930.65
mp-1177903
10.32527
0.951712
1.611285
other
Li8Mn4F16
28
14
330.21
mp-556226
13.820772
4.127381
-2.344126
other
Na12B36O60
108
14
1,188.97
mp-27968
12.234653
7.717518
-0.930552
other
Li24Ge8O28
60
14
631.93
mp-771843
14.305024
7.739799
-6.812871
other
Mn6P4O16
26
14
317.27
mp-760979
10.694368
11.601943
2.446058
other
Na8Ti8O20
36
14
622.03
mp-1101395
11.68351
11.12022
-2.417546
other
Sm8W12O48
68
14
1,559.51
mp-1102982
-7.908725
-5.095681
5.404329
other
La4Ga4Ni4
12
14
252.4
mp-557224
9.576531
7.346837
-3.243268
other
Hg4Se4O12
20
14
319.57
mp-1201533
-3.755028
-1.691486
-5.394606
other
K36Fe4S28
68
14
2,007.48
mp-8869
10.486488
7.48338
3.077657
other
Y8S8O4
20
14
386.01
mp-33690
10.740935
8.116848
2.725472
other
Pr4S4O4
12
14
226.71
mp-768895
8.757118
12.677005
-1.2192
other
Rb4Fe20O32
56
14
814.7
mp-9789
-2.328623
-0.588497
-5.343397
other
Ca4P4S12
20
14
443.78
mp-1179247
7.043033
5.586953
-4.029573
other
Te8N8O28
44
14
714.13
mp-1201134
6.827093
4.954599
-4.697463
other
Cu4C8O24
36
14
688.77
mp-23419
10.863663
9.33834
-0.812971
other
Sb8Cl4O10
22
14
435.43
mp-760002
9.793389
0.397357
0.182397
other
Li12Cu8F28
48
14
534.09
mp-637982
-3.322489
-1.222799
-5.383552
other
As20Pb12S40
72
14
1,833.72
mp-1200575
-9.260174
-0.892377
4.217874
other
Sc16B48Rh68
132
14
1,586.63
mp-29463
2.235716
2.462945
1.333371
other
Li4Be4N4
12
14
100.43
mp-1211594
1.092002
1.806064
-5.23476
other
K4Ho8Cl28
40
14
1,104.49
mp-1179393
9.415944
6.137559
-3.676085
other
Tl4B20O48
72
14
941.45
mp-1213604
2.845077
3.225076
-4.125411
other
Cu4Cl12O8
24
14
610.92
mp-8842
-4.987008
-4.783551
5.208183
other
Ca4Si4Pd4
12
14
236.31
mp-14926
8.603149
1.226438
1.881425
other
Sr8Sc4F28
40
14
545.27
mp-766076
9.471126
7.839062
-6.127326
other
Co12P12O48
72
14
1,144.82
mp-1207452
-6.476888
-3.718722
4.051268
other
Zr6U4Ge8
18
14
375.7
mp-1199208
10.589539
8.927032
-6.852579
other
V4P8O32
44
14
594.39
mp-27750
8.121725
2.120654
-0.951375
other
As4Xe4F28
36
14
600.15
mp-1197159
9.470445
8.002005
-6.000173
other
Fe8P16O56
80
14
1,093.78
mp-9635
-3.84863
-1.368594
-5.679515
other
Ag4Hg2S4
10
14
214.47
mp-14941
8.856174
1.26664
1.176532
other
Al8Pb12F48
68
14
901.05
mp-26888
12.259347
9.180496
-7.529914
other
V4P8O28
40
14
498.27
mp-4734
13.18012
5.796369
-6.689657
other
Na8P8O24
40
14
510.77
mp-1189652
4.600842
3.013291
-3.79426
other
C4S4N8
16
14
309.02
mp-1209045
10.486296
7.488915
-6.324158
other
U8P24O88
120
14
1,877.74
mp-770561
11.117373
8.130361
-7.812
other
Mn8P16O52
76
14
962.56
mp-1198130
8.209596
8.268018
-4.317631
other
Ni8As8O36
52
14
698.44
mp-3237
9.264239
0.609966
0.600798
other
Na4Cu2F8
14
14
165.63
mp-510243
-2.883348
-1.041053
-5.447426
other
Eu4B8S16
28
14
519.48
mp-1202790
-2.834644
-2.429862
-5.881616
other
Pr8Si4S20
32
14
888.59
mp-28406
3.100833
3.159014
-4.201793
other
S4Cl8O4
16
14
396.52
mp-504937
0.792543
2.069836
-4.197865
other
Sb4Se36Cl28
68
14
2,260.31
mp-755977
-1.061937
2.250262
-2.699192
other
Ca4Pb4I16
24
14
1,110.04
mp-1211760
1.41971
2.350084
-5.58847
other
K4Eu8Cl28
40
14
1,264.4
mp-1189432
7.914355
0.058496
-4.638831
other
Zn2H12C4
18
14
219.61
mp-32334
8.722928
7.897796
-5.159781
other
Ni4P8O28
40
14
517.53
mp-753879
10.31897
7.458813
2.93183
other
Pr8S8O4
20
14
441.7
mp-778506
10.12156
2.204258
1.746463
other
Li8V4F20
32
14
362.44
mp-18139
-4.558661
-5.607385
0.446647
other
Na20Si4As12
36
14
813.18
mp-1217700
6.272726
5.600448
-3.757924
other
Te2I12O16
30
14
913.06
mp-1195074
-2.949296
-2.401832
-4.558931
other
U8Pb4S20
32
14
744.27
mp-604337
7.078868
2.447085
-4.262311
other
Cd8H32N64
104
14
1,209.66
mp-17704
11.970557
7.04865
0.735406
other
Tm8Si4O20
32
14
387.52
mp-626872
10.646128
8.820499
-5.072953
other
V12H8O32
52
14
592.55
mp-554914
11.318869
7.664996
-3.892925
other
Hg12P4O16
32
14
569.74
mp-756273
11.249868
4.260061
-3.269889
other
Lu4H12O12
28
14
328.68
mp-5409
10.864837
8.246462
2.432352
other
Y16Al8O36
60
14
838.82
mp-769947
10.015779
8.958757
0.565772
other
K16Ti4O16
36
14
687.43
mp-1043793
6.678127
9.005719
-1.083724
other
Ca4Bi8O20
32
14
607.1
mp-29039
13.910766
7.949577
-6.22324
other
P12Ru4O36
52
14
777.32
mp-28341
1.719429
2.394719
-5.147255
other
Li4Ga4Cl16
24
14
589.17