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-9454
7.89615
10.239018
1.287465
other
Sr6Mg2Ir2O12
22
167
299.07
mp-777476
11.257711
8.046114
-7.679279
other
Cr2Fe4P6O24
36
167
435.96
mp-997184
9.391537
10.747122
2.052061
other
Ca6Ti2Ni2O12
22
167
269.61
mp-669389
8.177258
10.018089
1.280113
other
Sr6In2Rh2O12
22
167
317.24
mp-560990
9.398516
6.935732
-3.567825
other
Ca6Fe4Se12O36
58
167
859.44
mp-850780
14.06884
8.88268
-6.685981
other
V4Sn2P6O24
36
167
483.7
mp-17557
7.482695
10.538239
1.601105
other
Sr6Sc2Ni2O12
22
167
300.92
mp-1190404
9.904009
10.017136
3.417022
other
Sr6Li2Nb2O12
22
167
320.97
mp-1196700
8.254019
1.115112
-3.923583
other
Cs6Y4H36N18
64
167
895.87
mp-1190597
-3.219651
-1.741062
-4.929483
other
Ba6U2Mn2S12
22
167
577.99
mp-704125
11.577879
11.033053
-4.017884
other
Nd4Zr6Mo18O72
100
167
1,647.97
mp-758304
8.994158
8.260513
-5.676895
other
Li2Co4P6O24
36
167
412.71
mp-778169
8.630746
6.088503
-5.987645
other
Li2Cu4S6O24
36
167
449.51
mp-510070
7.652597
10.594287
0.860058
other
Sr6Ni2Rh2O12
22
167
303.35
mp-6125
13.636136
5.707096
-7.443795
other
Rb2Ti4P6O24
36
167
489.36
mp-540577
14.340464
5.11058
-7.467263
other
K2Zr4P6O24
36
167
550.57
mp-541929
12.259278
7.223205
-7.160855
other
Fe4Si4P12O44
64
167
779.23
mp-775273
13.075068
7.996009
-7.167653
other
Cr4Te2P6O24
36
167
471.31
mp-10392
8.062794
10.02829
1.132462
other
Sr6Cd2Pt2O12
22
167
324.47
mp-768608
9.219899
5.489173
-6.771348
other
Li2Mn4S6O24
36
167
481.22
mp-772873
13.603846
9.018841
-7.154854
other
V4Ni2P6O24
36
167
441.01
mp-567781
1.34371
1.967421
-4.683331
other
Cs6Zr14B2Cl40
62
167
1,765.3
mp-505248
7.446811
8.761277
-3.537122
other
Rb6Cr2H12O12
32
167
528.89
mp-541674
13.656353
8.750313
-5.606105
other
Na2Mo4P6O24
36
167
505.44
mp-6361
9.967869
9.937133
3.398172
other
Na2Sr6Nb2O12
22
167
331.13
mp-1190712
-4.495679
-3.28786
-3.494216
other
Ba6U2Mn2Se12
22
167
657.66
mp-776158
11.087016
8.344213
-7.996462
other
Mn4Cr2P6O24
36
167
441.31
mp-12362
9.498089
9.141685
-1.580889
other
Ag2Hg6Sb2O12
22
167
362.18
mp-10461
9.426855
9.099254
1.786994
other
Na2Sr6Sb2O12
22
167
331.05
mp-1190486
9.79883
10.056478
3.472149
other
Sr6Li2Ta2O12
22
167
319.57
mp-734815
10.149488
3.116258
-3.903589
other
Cr2H24Cl6O12
44
167
505.66
mp-6475
14.396815
5.119129
-7.522137
other
Na2Zr4P6O24
36
167
531.43
mp-22533
7.533543
11.78523
1.533384
other
Ca6Mn2Ni2O12
22
167
262.22
mp-569563
1.110025
1.591647
-4.164504
other
Ba6Zr12Be2Cl36
56
167
1,500.72
mp-556316
6.494472
8.435514
-0.011872
other
Ba6Na2Bi2O12
22
167
397.03
mp-1190024
9.199635
9.099676
1.884724
other
Ba6Na2Sb2O12
22
167
379.02
mp-667344
14.381598
5.577665
-6.434009
other
Rb18Nb30P12O114
174
167
2,756.99
mp-9745
8.145337
10.00467
1.461318
other
Ba6Na2Ru2O12
22
167
366.45
mp-6342
7.49769
10.677774
1.151105
other
Li2Ca6Ru2O12
22
167
271.61
mp-1043685
14.387554
7.291367
-5.691198
other
Mg2Ti4P6O24
36
167
448.91
mp-694892
7.533081
11.969425
2.079577
other
Ca2La6Mn8O24
40
167
481.29
mp-20659
6.32287
9.800776
0.156404
other
Sr12Ni4Pb4O24
44
167
638.05
mp-6233
7.71441
10.39161
1.303468
other
Na2Sr6Ru2O12
22
167
318.68
mp-1196274
7.46442
6.850248
-4.38516
other
Mg4C6Cl2O30
42
167
590.23
mp-6721
7.685732
10.424367
1.39157
other
Sr6Li2Ru2O12
22
167
307.27
mp-570107
4.257757
2.278844
-3.247232
other
Zn6Fe4C24N24
58
167
1,511.09
mp-1190259
-4.589918
-3.224074
-3.438194
other
Ba6U2Fe2Se12
22
167
644.56
mp-1190151
9.438394
9.122721
1.791031
other
Sr6Li2Sb2O12
22
167
318.41
mp-1021514
13.009615
5.553885
-7.74013
other
Na2Ge4P6O24
36
167
436.36
mp-771649
14.823596
8.299221
-4.851182
other
Ti4V2P6O24
36
167
456.47
mp-562501
13.813903
7.651304
-6.33434
other
Si4P12Ru4O44
64
167
812.73
mp-1194549
13.719729
4.391689
-2.091007
other
Ba4B12Pb2O24
42
167
585.85
mp-560812
14.033068
7.349722
-4.219916
other
K2U4P6O24
36
167
618.86
mp-551706
7.376882
10.787444
0.826616
other
Ca6Co2Rh2O12
22
167
267.88
mp-1200241
11.094873
4.548859
-3.992822
other
Rb6Cr2H12O12
32
167
439.31
mp-558890
13.83077
4.160964
-2.301061
other
Ba2Li2B18O30
52
167
620.12
mp-771314
14.339446
7.491662
-6.135177
other
Ti4Ni2P6O24
36
167
438.34
mp-757011
10.245293
8.400075
-7.324024
other
Mn4Co2P6O24
36
167
443.96
mp-559635
7.936531
10.126079
1.253766
other
Sr6Ca2Ir2O12
22
167
323.15
mp-9746
7.709158
9.976841
1.17293
other
Ba6Na2Ir2O12
22
167
366.42
mp-561610
7.195598
11.933746
1.570319
other
Ca6Mn2Co2O12
22
167
262.19
mp-6071
7.458807
10.392644
1.156516
other
Sr6Li2Ir2O12
22
167
307.26
mp-554409
12.413384
7.376232
-7.428516
other
Na14Fe8P12O48
82
167
964.44
mp-561018
13.611856
4.256656
-1.839038
other
Na6Sc4B6O18
34
167
438.49
mp-6723
7.895307
10.297412
1.227727
other
Sr6Zn2Ir2O12
22
167
309.28
mp-775212
13.948714
8.926023
-7.127397
other
Mn2V4P6O24
36
167
455.82
mp-558669
13.796947
4.628498
-1.687693
other
Sr2Al4B4O14
24
167
343.94
mp-768683
9.733949
4.918015
-6.892063
other
Li2Fe4S6O24
36
167
463.43
mp-16907
6.291728
5.042639
-4.583239
other
Rb2Np2N6O22
32
167
525.1
mp-1193413
8.477981
3.086596
-5.546838
other
Sc2H6C6O12
26
167
341
mp-15269
7.911899
10.185813
1.179375
other
Sr6Cd2Ir2O12
22
167
323.35
mp-1306720
7.085023
13.295625
-1.416456
other
Li4Ni6Sb2O16
28
167
295.31
mp-555717
7.26749
10.024989
0.640095
other
K4Nd4Ir2O14
24
167
368
mp-778242
14.61142
7.964546
-5.223461
other
Ti4Fe2P6O24
36
167
455.43
mp-560091
14.322314
5.098521
-7.438722
other
Cs2Zr4P6O24
36
167
558.01
mp-559348
13.60617
4.621012
-1.699702
other
Ba2Zr2B4O12
20
167
273.21
mp-555812
6.184318
8.578715
-0.065008
other
Na2Sr6Bi2O12
22
167
349.86
mp-8773
8.588338
3.86365
-7.076788
other
K6C2O6F2
16
167
273.17
mp-554023
13.558935
4.432281
-2.226405
other
Be4B2O6F2
14
167
145.52
mp-620569
4.117687
2.19377
-3.062591
other
K8Zn4C16N16
44
167
930.9
mp-504994
10.955538
4.43444
-3.916657
other
K6Cr2H12O12
32
167
387.65
mp-6281
7.550175
10.622598
1.090763
other
Na2Ca6Ru2O12
22
167
282.59
mp-541035
6.245616
4.977705
-4.6271
other
Cs2U2N6O22
32
167
561.25
mp-768616
8.657895
6.021066
-6.146292
other
Li2Co4S6O24
36
167
450.66
mp-770367
10.280451
4.708525
-7.037203
other
Li2V4S6O24
36
167
473.88
mp-1190457
-3.252627
-1.767825
-5.038793
other
Ba6U2Ag2S12
22
167
616.05
mp-570449
-4.624349
-6.903612
2.71072
other
Ba28Na14Ca2N12
56
167
2,376.54
mp-13042
9.859574
9.961534
3.418463
other
Na2Sr6Ta2O12
22
167
330.32
mp-2716361
13.967973
3.837118
-7.46122
other
Na24Si18Ge12O72
126
167
1,442.44
mp-1201885
11.741206
4.602391
-3.403065
other
Mg4B24H48O70
146
167
1,421.84
mp-557689
13.787094
4.617799
-1.752024
other
Ca2Al4B4O14
24
167
321.83
mp-1200852
11.591876
7.388014
-4.367919
other
Na2Ti4As6O24
36
167
530.57
mp-1238356
7.457257
0.892548
-4.163004
other
Cs6Y4H36N18
64
167
943.27
mp-743768
7.427432
11.860136
2.148962
other
Ba2La6Mn8O24
40
167
499.85
mp-18247
8.403986
9.905302
1.86369
other
Sr6Sc2Rh2O12
22
167
308.06
mp-1195672
11.27659
8.930661
1.315142
other
Rb4U6Mn2O22
34
167
527.92
mp-8774
8.778909
3.817078
-7.25584
other
Rb6C2O6F2
16
167
319.25
mp-770256
12.696623
8.074905
-2.164592
other
Li8V4Si6O24
42
167
463.87
mp-6150
14.569357
3.988801
-6.877807
other
Na8Zr4Si6O24
42
167
561.9
mp-1195770
11.906584
7.411468
-4.45802
other
Li2Zr4As6O24
36
167
568.33