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-19501
8.628013
10.934842
1.104195
other
Ba12Na4V4Ru4O34
58
194
924.23
mp-554687
8.715421
10.327178
1.34219
other
Ba12Na4As4Ru4O34
58
194
921.15
mp-571248
4.066587
2.270552
-3.142925
other
Cs4Na2Au6C12N12
36
194
851.82
mp-1214895
7.33249
10.017939
0.858901
other
Ba12Na4Ta4Mn4O34
58
194
941.2
mp-1214492
9.524097
8.774881
3.29974
other
Ba10Tm4Zr2Al4O26
46
194
783.24
mp-1211996
10.334999
12.11943
-3.79823
other
K4Ba2V4Cl2O14
26
194
464.61
mp-558566
9.563198
8.742199
3.239487
other
Ba10Er4Zr2Al4O26
46
194
789.29
mp-1228254
6.731767
11.013616
0.477138
other
Ba10Co8Pt2Cl2O26
48
194
745.18
mp-1214525
9.427967
8.734012
3.194691
other
Ba10Gd4Zr2Al4O26
46
194
812.39
mp-542399
7.187357
10.56594
0.651363
other
Ba12Na4Mn4Ru4O34
58
194
914.11
mp-559863
8.21841
10.681176
0.905813
other
Ba12Na4Cr4Ru4O34
58
194
917.75
mp-774691
8.886073
10.167562
1.335288
other
Ba12Na4P4Ru4O34
58
194
883.8
mp-1198263
8.571386
1.764718
-0.287934
other
Ba4B4As2H6F36
52
194
762.67
mp-1194624
8.512536
3.751928
-6.738701
other
K4Pb6C6O18F4
38
194
591.23
mp-1214534
9.507743
8.755392
3.206733
other
Ba10Lu4Zr2Al4O26
46
194
770.57
mp-638276
4.575841
2.065783
-2.683612
other
Li2Eu8C6I6N12
34
194
679.24
mp-556236
8.860643
3.448468
-7.230358
other
Na6Ce4C8O24F2
44
194
520.19
mp-723540
2.088541
2.180744
-5.364243
other
K12Bi2H6Cl16F8
44
194
1,087.5
mp-1214664
10.093161
10.742202
2.292391
other
Ba12Na4Ta4V4O34
58
194
949.53
mp-1191763
8.504718
3.753143
-6.70555
other
K2Pb4C4O12F2
24
194
350.92
mp-1214677
10.307059
10.69872
2.273597
other
Ba12Na4Nb4V4O34
58
194
952.59
mp-1198788
11.760086
6.545022
-0.316298
other
Ba12Li4Si8Cl2O30
56
194
859.56
mp-1214494
9.487151
8.811049
3.254008
other
Ba10Y4Zr2Al4O26
46
194
802.59
mp-1197405
10.577033
4.092687
-4.940697
other
Ca6Ge2H24S4O34
70
194
712.31
mp-1214508
9.476455
8.747484
3.248841
other
Ba10Ho4Zr2Al4O26
46
194
794.08
mp-1214658
9.592286
10.285927
1.006945
other
Ba12Na4V4Sb4O34
58
194
951.82
mp-1214806
7.407029
10.12021
1.106482
other
Ba12Na4Mn4Nb4O34
58
194
944.09
mp-1214540
7.819654
8.395032
0.248226
other
Ba10Yb4Zr2Al4O26
46
194
798.44
mp-41734
12.962189
6.202235
-0.656057
other
Na8Al6Si6S1O28
49
195
770.44
mp-608162
6.35109
4.992546
-4.460095
other
K2Cu1Pb1N6O12
22
196
291.54
mp-1195588
8.501648
2.559973
-4.97988
other
Sm2H18C10N4O16
50
20
562.75
mp-1201112
12.56855
4.269665
-3.034511
other
Rb4Ga2B10H16O28
60
20
717.2
mp-1195317
13.057092
5.039832
-1.870395
other
Ba6B6Pb4Cl2O18
36
20
618.25
mp-1200680
8.50281
2.542819
-4.969327
other
Dy2H18C10N4O16
50
20
544.35
mp-1225259
10.999272
8.989422
-4.084143
other
K10Mo16As2H12O64
104
20
1,555.83
mp-1194742
13.08547
5.119095
-1.871424
other
Ba6B6Pb4Br2O18
36
20
613.98
mp-1195652
8.502086
2.572108
-4.993457
other
Lu2H18C10N4O16
50
20
518.33
mp-1196254
12.549271
4.279544
-2.987847
other
K4Ga2B10H16O28
60
20
696.41
mp-973335
8.021184
1.447935
-4.58587
other
Hg4H12C2N6Cl10
34
20
591.25
mp-560326
13.145229
5.052612
-1.237632
other
Ba10B6C2N2O18
38
20
642.85
mp-1195209
8.516581
2.555865
-4.974403
other
Ho2H18C10N4O16
50
20
536.2
mp-1195360
8.503539
2.563161
-4.961313
other
Tm2H18C10N4O16
50
20
523.13
mp-1200079
11.564581
3.649215
-3.722909
other
Al2B10H32N4O28
76
20
722.64
mp-1227913
9.338565
9.350393
0.909148
other
Ba2Na2Sr6Sb6O24
40
20
565.02
mp-676483
13.131145
5.753966
-6.585086
other
Na2Li2Zn2P4O14
24
20
307.03
mp-1220839
9.468694
12.264058
1.290242
other
Na1La1Ti8Cu6O24
40
200
419.36
mp-1210081
9.697593
12.334956
1.248508
other
Na1Ti8Cu6Bi1O24
40
200
416.5
mp-683928
6.376329
4.986294
-4.442957
other
K10Ce2Cu4N24O48
88
201
1,215.45
mp-21963
6.391137
4.963459
-4.510794
other
Y2Tl10Cu4N24O48
88
201
1,191.28
mp-583424
6.388899
4.987276
-4.502478
other
Cs10Ce2Cu4N24O48
88
201
1,438.62
mp-687239
6.415146
5.026462
-4.392415
other
K10Y2Ni4N24O48
88
201
1,195.72
mp-41331
9.264015
11.215943
-0.561221
other
Ca2Ga4Cu6Sb4O24
40
201
431.86
mp-561655
6.522699
4.912714
-4.52183
other
Y2Tl10Co4N24O48
88
201
1,191.3
mp-704908
6.465806
4.930949
-4.427735
other
K10Ce2Co4N24O48
88
201
1,119.99
mp-562105
6.454449
4.923636
-4.481684
other
Rb10Ce2Co4N24O48
88
201
1,262.03
mp-559686
6.470003
5.012588
-4.450129
other
Ce2Tl10Ni4N24O48
88
201
1,306.96
mp-557781
6.425323
5.010744
-4.431501
other
Rb10Ce2Ni4N24O48
88
201
1,317.32
mp-686705
9.571847
12.1319
1.258511
other
Ca2Nb4Ga4Cu6O24
40
201
432.58
mp-704967
6.41774
5.023268
-4.390448
other
K10Ce2Ni4N24O48
88
201
1,230.04
mp-21539
9.592838
12.480443
-0.856197
other
Ca2Cr4Cu6Sb4O24
40
201
432.77
mp-567605
6.489353
4.886963
-4.492329
other
Ce2Tl10Fe4N24O48
88
201
1,243.62
mp-21973
6.498128
4.910187
-4.521513
other
Ce2Tl10Co4N24O48
88
201
1,245.26
mp-687247
6.461181
4.934121
-4.436754
other
K10Y2Co4N24O48
88
201
1,110.76
mp-559047
6.38181
4.988248
-4.481881
other
Rb10Ce2Cu4N24O48
88
201
1,326.2
mp-1194983
8.79007
12.425189
-1.001114
other
Ca2Fe4Cu6Sb4O24
40
201
439.18
mp-555459
6.409571
4.951996
-4.507185
other
Ce2Tl10Cu4N24O48
88
201
1,250.13
mp-687255
6.488291
4.947412
-4.421421
other
K10Ce2Fe4N24O48
88
201
1,159.1
mp-720504
7.681356
11.940684
-0.281945
other
Ca2Ga4Cu6Ru4O24
40
201
418.45
mp-704975
6.433222
5.007818
-4.44729
other
Cs10Ce2Ni4N24O48
88
201
1,445.5
mp-19863
6.334074
4.999382
-4.486537
other
K2Cu1Pb1N6O12
22
202
320.12
mp-22139
6.395391
5.007688
-4.417464
other
K2Ni1Pb1N6O12
22
202
306.55
mp-20701
6.441326
4.930989
-4.434479
other
K2Ba1Co1N6O12
22
202
315.36
mp-22118
6.428511
4.918113
-4.49879
other
Rb2Co1Pb1N6O12
22
202
306.49
mp-1193688
7.827052
4.13024
-4.622187
other
Na1H8Rh1N8O12
30
202
320.81
mp-22650
6.396447
4.993251
-4.396883
other
K2Ca1Ni1N6O12
22
202
286.93
mp-1192663
6.396638
5.015275
-4.499764
other
Tl2Cu1Pb1N6O12
22
202
316.2
mp-21212
6.431323
4.930755
-4.467622
other
K2Co1Pb1N6O12
22
202
295.83
mp-1211916
6.336398
4.980177
-4.439679
other
K2Na1Co1N6O12
22
202
272.86
mp-19374
6.407023
5.005162
-4.402697
other
K8Sr4Ni4N24O48
88
202
1,229.19
mp-22515
6.322434
5.008984
-4.427793
other
Rb2Cu1Pb1N6O12
22
202
327.37
mp-19732
6.333782
4.990374
-4.538535
other
Cs2Cu1Pb1N6O12
22
202
343.37
mp-1204704
14.38443
7.875401
-6.428588
other
Na12V4P12N4O36
68
198
877.17
mp-867518
8.558942
1.502828
-4.42985
other
Cr4H72C20N16O16
128
198
1,298.2
mp-1224126
13.307092
5.667021
-7.079369
other
K8Al4Sn4P12O48
76
198
982.91
mp-1199776
7.841738
0.291524
-4.470472
other
Sn24H224C72I8N8
336
198
4,549.95
mp-723059
6.807216
4.76255
-4.818231
other
Li12Nd8H24N36O120
200
198
2,448.55
mp-1213813
12.253827
6.527099
-7.26719
other
Cs8Zr4Mn4P12O48
76
198
1,125.74
mp-532541
13.261445
5.566429
-6.737128
other
Cs4Ba4In8P12O48
76
198
1,132.32
mp-1195148
8.50831
3.293663
-5.929328
other
Na4Mn4H12C12O24
56
198
837.98
mp-532727
14.10408
4.909383
-7.104778
other
K8Y4Zr4P12O48
76
198
1,152.44
mp-725402
11.496643
7.347281
-7.275714
other
K4Ba4Fe8P12O48
76
198
1,007.01
mp-867519
8.57632
1.395264
-4.374085
other
Mo4H72C20N16O16
128
198
1,340.63
mp-24440
10.058911
3.007339
-4.096395
other
Na12Sb4H72S16O36
140
198
1,734.44
mp-699888
12.240271
6.884089
-7.433378
other
Na8Ti4Fe4P12O48
76
198
971.36
mp-1205176
12.511713
5.206318
-5.267402
other
Ti8P12H28N4O52
104
198
1,008.75
mp-1203798
7.898363
0.208044
-4.537757
other
Cu8P16H144C48Cl8
224
198
2,793.47
mp-677014
13.841809
5.160722
-7.063835
other
K8Er4Ti4P12O48
76
198
1,085.77
mp-21703
14.24762
7.468934
-5.634631
other
Na12Ti4P12N4O36
68
198
892.97
mp-532655
12.325864
6.697824
-7.256874
other
Rb8Ti4Fe4P12O48
76
198
1,015.68
mp-1205112
10.220787
4.381514
-6.21193
other
Cs4Na8H12S12O48
84
198
1,230.62