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-667283
10.040421
10.906773
-2.267528
other
Sr20Re12Cl4O60
96
62
1,502.93
mp-6250
9.629261
8.591891
3.12905
other
Ba4Tm8Zn4O20
36
62
495.65
mp-561405
8.37064
1.617318
-4.55278
other
Sn4H32C16O16
68
62
747.21
mp-1193749
13.498069
5.199613
-6.561064
other
Rb4Mg4P4O16
28
62
488.52
mp-1209226
8.698402
0.705997
0.550437
other
Rb4Ga4Ag4F24
36
62
589.74
mp-555644
13.106055
5.650309
-6.395773
other
Al8Tl12P12O48
80
62
1,185.34
mp-1227500
7.40776
12.029011
2.004092
other
Ca4La8Mn12O36
60
62
715.18
mp-850227
10.710979
8.144076
-6.874112
other
Li4Cr4P4O20
32
62
356.65
mp-756841
8.646564
10.984397
0.308329
other
Ba4Li8Ni4O12
28
62
395.52
mp-541694
-3.391477
-4.601209
0.838244
other
K8Na12Si4P12
36
62
930.83
mp-1190688
10.974727
3.960689
-3.230738
other
Tm4H8Cl4O8
24
62
293.59
mp-1199990
4.590404
2.872199
-3.478409
other
Ag8C16I12N4
40
62
1,180.95
mp-20014
10.315534
11.542778
-4.12671
other
Al4V4Mo4O28
40
62
586.85
mp-1218223
-3.158585
-2.22629
-5.628975
other
Sr4La4Cu4S12
24
62
541.42
mp-1203555
7.588178
0.42976
-4.124207
other
Li4B4H28N4
40
62
397.95
mp-1203541
9.425877
7.010878
-3.603098
other
K4Ga4Se8O24
40
62
614.1
mp-1197204
4.645035
2.940531
-3.748511
other
Mn4C12N4Cl12
32
62
756.76
mp-22202
9.294373
8.776604
2.993025
other
Ba4Tm8Cu4O20
36
62
489.11
mp-1207737
12.150731
5.620419
-5.776603
other
Zn12P8H16O32
68
62
994.15
mp-26923
10.930036
8.26819
-7.150379
other
Li4Cr4P4O20
32
62
333.74
mp-510646
-2.512122
-0.684662
-5.434578
other
Tl4P4Pb4S16
28
62
746.71
mp-21541
14.726909
8.677963
-5.507197
other
Ca4V8P8O36
56
62
702.44
mp-757314
14.910359
8.005293
-5.530987
other
Li4Cr4P4O16
28
62
305.27
mp-758766
12.060066
7.408072
-1.812941
other
Li12Fe4Si8O28
52
62
562.75
mp-558660
12.972383
6.00896
-5.618606
other
Mg8Bi4P4O24
40
62
488.99
mp-647102
7.832545
2.734481
-1.502254
other
K4N4O4F8
20
62
353.27
mp-560573
10.647749
9.408882
-2.276056
other
La8Te12Mo4O48
72
62
1,213.82
mp-556087
-2.401547
-3.022288
-5.418037
other
Pr24S16N12Cl4
56
62
1,300.78
mp-505234
12.870764
5.979527
-5.839927
other
Ba4P8Pb4O28
44
62
692.71
mp-504583
12.878714
6.247168
-3.231002
other
Fe4Co4B4O16
28
62
281.17
mp-17057
-4.219461
-3.087593
-4.026666
other
Sr8Sn4Se12F8
32
62
757.52
mp-1193277
-4.248551
-2.661833
-3.489424
other
Cs4P4Pb4Se16
28
62
923.15
mp-26963
13.424835
8.918953
-7.380014
other
Li4V4P4O20
32
62
350.89
mp-1212951
9.617599
2.295427
-2.826233
other
Fe4H16N8F20
48
62
545.66
mp-1191152
-3.147466
-2.414354
-5.64341
other
Pr4Eu4Cu4S12
24
62
521.26
mp-504978
9.466266
0.748496
0.795066
other
Na8Cr4Cu4F28
44
62
577.44
mp-1210454
11.505656
4.160899
-7.813908
other
Na4Al4S8O32
48
62
576.81
mp-1005792
-5.530768
-4.484425
0.33298
other
Sm8Cu4As12O4
28
62
555.9
mp-647727
8.158949
2.291632
-0.83366
other
Re8N8Cl4F36
56
62
1,038.37
mp-1041008
11.529657
8.040865
-8.108627
other
Mg4Mn8P8O36
56
62
665.04
mp-770739
8.972082
13.645431
-0.444453
other
Li4Ti4Fe4O16
28
62
311.22
mp-1209739
10.451271
8.856213
3.100392
other
Pr12Ti4Cl20O16
52
62
1,006.74
mp-6615
4.722075
2.891749
-3.808489
other
C8Se4S8N8
28
62
654.74
mp-10233
2.464521
2.283814
1.136829
other
Ca8B4N8F4
24
62
340.96
mp-561076
-2.498179
-2.715523
-5.560961
other
La12Ga4S20O4
40
62
882.19
mp-567548
9.543984
6.969552
-3.404747
other
Ba4Co4Se8O24
40
62
626.4
mp-728328
12.085466
6.708365
-1.207055
other
Na8Be8Si24O64
104
62
1,310.53
mp-1194961
11.024945
12.079409
-3.644377
other
Nb4Tl4V8O32
48
62
752.06
mp-1201423
8.66734
5.430019
-4.360209
other
Ba8Sn4Se16O20
48
62
1,164.37
mp-1200315
10.065421
10.87454
-3.928003
other
Na4Cu4Mo4O20
32
62
445.13
mp-1013953
9.311005
8.390544
-6.411918
other
Li4Co8P8O36
56
62
608.61
mp-555273
11.871967
7.126203
-0.114057
other
Ca12Ge4Cl8O16
40
62
709.98
mp-1201278
-2.596702
-0.622269
-5.274094
other
K8P8Pd4S24
44
62
1,181.31
mp-510580
2.559828
-0.478937
-1.672878
other
Nd4Ni4Sn4H4
16
62
269.04
mp-1199462
5.531754
3.286404
-4.573814
other
Tc4C20Cl4O20
48
62
838.62
mp-1197513
8.491525
7.371781
-4.144369
other
U4B4C4O20
32
62
659.41
mp-1043475
9.288304
7.872443
-5.812943
other
Ca4Ni8P8O36
56
62
674.91
mp-1195675
-3.103017
-2.294257
-5.548831
other
La8Cu4Bi4S20
36
62
820.93
mp-1196500
13.535811
6.919746
-6.65182
other
Mn4Tl4P12O36
56
62
887.34
mp-1208778
7.503162
8.560299
-0.087354
other
Sr8Sm4Be4O20
36
62
471.84
mp-770386
8.014025
14.284296
-0.790727
other
Li4Mn4Al4O16
28
62
270.93
mp-1199635
6.148407
3.453168
-3.450207
other
Cu4C32N8Cl16
60
62
1,219.62
mp-26267
12.380155
7.273081
-7.319278
other
Li8Cu4P16O48
76
62
901.66
mp-1192518
3.15606
2.506159
-3.585717
other
Pb4C4Br12N4
24
62
944.81
mp-17387
12.701255
8.839539
-5.673655
other
Li4V4As4O20
32
62
362.35
mp-1195309
-4.459825
-3.043363
-3.610982
other
Ba8Ga4As4Se20
36
62
1,099.01
mp-605486
11.626892
11.202719
-3.789977
other
Sc4Tl4Mo8O32
48
62
788.4
mp-758092
13.149723
7.678131
-7.11061
other
Li4Co4P4O16
28
62
299.23
mp-1195111
7.932906
5.489782
-5.544253
other
Ba4Al8C8O44
64
62
964.1
mp-768436
13.002623
5.88194
-2.907294
other
Li8Mn4B4O16
32
62
306.23
mp-1043389
11.39031
8.562828
-6.322761
other
Ni4P8W4O36
52
62
726.03
mp-780767
10.367123
0.716332
0.436648
other
Li4Co8O4F12
28
62
324.58
mp-17487
11.717126
7.295588
0.247047
other
Na4Er4Ge4O16
28
62
377.01
mp-26393
14.262597
7.715193
-6.816154
other
Li4Mn16P12O48
80
62
953.62
mp-1203806
-3.194532
-1.61347
-5.484367
other
Ba8Ga4Sb4S20
36
62
1,011.03
mp-6224
12.562272
6.561412
0.000309
other
Li4Sc4Si4O16
28
62
309
mp-759575
13.77226
8.030096
-0.877767
other
Li8Fe4Si4O16
32
62
343.72
mp-631350
5.725429
3.551748
-4.679646
other
Mn4C20Br4O20
48
62
837.33
mp-1204961
3.249993
3.160929
-3.817745
other
Co4Hg4N24Cl20
52
62
1,533.36
mp-643727
10.013965
4.297434
-3.588897
other
H4Pb4Br4O4
16
62
316.91
mp-559307
-2.965928
-0.751575
-4.823971
other
Cu12P16S12I12
52
62
1,409.5
mp-560818
13.273025
4.824186
-1.529275
other
Sr20B12O36F4
72
62
1,033.74
mp-1202467
7.413785
5.859511
-4.816461
other
Ba4Se4S16O32
56
62
1,296.23
mp-863427
12.654383
7.034217
-0.769825
other
Li12Si8Bi4O28
52
62
641.01
mp-561268
11.350526
7.747558
-2.893972
other
As12Pb8Cl4O24
48
62
915.47
mp-1040886
13.799318
8.061057
-6.950433
other
Mg4Cr8P8O36
56
62
650.92
mp-1198143
5.942376
-0.281912
-3.22397
other
Ca4B8H40O4
56
62
565.14
mp-1220024
-3.117503
-2.431077
-5.655479
other
Pr4Eu4Cu4S12
24
62
517.26
mp-849345
13.596156
7.359457
-0.849271
other
Li8Mn8Si12O36
64
62
770.62
mp-867571
11.591117
8.057011
-8.166463
other
Li8Mn8P8O36
60
62
712.04
mp-559276
13.439465
4.942563
-2.333401
other
Al4B4Pb4O16
28
62
320.56
mp-23574
2.72796
2.786386
-4.490887
other
Sb4P4Cl32O4
44
62
1,387.81
mp-1040889
13.670788
7.864043
-6.893684
other
Ca4Cr8P8O36
56
62
687.42
mp-866638
5.432601
-0.448951
-2.998793
other
K4Sc4B16H64
88
62
951.22
mp-1213991
13.438777
7.594512
-0.802655
other
Ca4Mn4Si4O16
28
62
370.58
mp-1209401
10.034071
10.85832
-2.030647
other
Sr20Re12I4O60
96
62
1,570.84
mp-1193910
12.819989
8.134385
-1.061151
other
Mn4Zn4Ge4O16
28
62
343.2
mp-1195693
12.337177
6.960414
-6.177855
other
P8Pd4Pb4O28
44
62
627.68
mp-1195928
-3.186096
-2.310261
-5.335759
other
Ce8Cu4Bi4S20
36
62
810.66
mp-728313
8.251102
2.007314
-0.761726
other
Rb8As8O8F40
64
62
1,123.1