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-697593
-3.340087
-0.23447
-2.658906
other
Te28W4Cl20O4
56
54
1,746.96
mp-1198792
-4.899458
-1.922358
-2.406554
other
Te28W4Br20O4
56
54
1,869.19
mp-669435
7.369442
4.925271
-5.302147
other
K4La4C4O16
28
54
588.73
mp-557258
12.320171
6.874273
-6.550681
other
Tl16Cu16P24O84
140
54
2,157.75
mp-558049
11.584373
9.009509
-6.562557
other
Na8V12P8O52
80
56
1,081.05
mp-732241
5.82493
3.375049
-4.539689
other
Os16C64N4O48
132
56
2,610.95
mp-557130
10.352176
9.020291
-1.805398
other
Zn16Te8Cl16O24
64
56
1,310.81
mp-651231
5.599263
3.265782
-4.679538
other
Te8Ru16C44O44
112
56
2,096.4
mp-1195071
8.164733
2.10534
-0.792193
other
Hg4P8Xe20F88
120
56
2,358.58
mp-779879
8.822087
5.683729
-5.321989
other
Mn4H24S16O72
116
56
1,573.14
mp-1179910
7.16963
6.575597
-4.151618
other
Pr4Se8N4O52
68
56
1,103.91
mp-560121
9.277051
2.601807
-4.926858
other
H40C8N8O24
80
56
693.87
mp-1195299
11.604568
6.132879
-3.413763
other
K12Np4H8O24
48
56
765.69
mp-758889
14.504927
8.067005
-5.060424
other
Li4Fe16P12O48
80
56
1,154.4
mp-582882
11.868979
7.131341
-6.506819
other
Cu16P16Pb8O64
104
56
1,343.27
mp-706400
12.251163
5.063589
-5.294445
other
Ba4P8H16O32
60
56
710.63
mp-720254
10.197622
4.521846
-5.795349
other
Li8H16S12O48
84
56
1,069.89
mp-21563
13.647621
4.788096
-1.589372
other
Sr8Al8B8O32
56
56
759.33
mp-557746
9.56043
7.046593
-3.297376
other
Zn16Se8Cl16O24
64
56
1,187.08
mp-555178
9.362582
1.582617
-0.656133
other
Rb20H20O8F24
72
56
1,197.58
mp-582585
11.996768
6.99895
-6.828929
other
Sr8Cu16P16O64
104
56
1,321.58
mp-757516
11.843724
7.566557
-6.929051
other
Li4Ni16P12O48
80
56
1,019.94
mp-707881
9.647585
2.119574
-3.7347
other
Ge4H48N16F32
100
56
1,010.44
mp-568713
8.251142
0.736588
-4.439653
other
H32C8I12N4
56
56
997.54
mp-734194
9.766297
4.909345
-4.264821
other
Be4H32I8O40
84
56
926.94
mp-560471
13.571685
4.884631
-2.261911
other
Zn8B8Pb4O24
44
56
623.04
mp-653887
5.68204
3.38139
-4.635414
other
Co16Pb4C64O64
148
56
2,616.3
mp-950214
10.02907
8.916039
-1.760509
other
Cd16Te8Cl16O24
64
56
1,541.9
mp-23927
9.957054
2.00298
-3.766756
other
Ti4H48N16F32
100
56
841.88
mp-780784
14.454112
7.473168
-6.917985
other
Li4Mn16P12O48
80
56
1,181.86
mp-581532
11.396404
7.408585
-7.314507
other
Cs12Fe16P20O80
128
56
1,930.58
mp-560961
8.170341
2.335285
-4.660599
other
H44C40N4O32
120
56
1,215.76
mp-560419
12.878726
5.794428
-6.206881
other
K4Zn16P12O48
80
56
1,138.5
mp-1200149
10.198306
8.065408
-6.558226
other
Li4Fe8P16O56
84
56
1,012.18
mp-707120
9.153505
7.568796
-5.121577
other
Ba4P8H8O32
52
56
724.2
mp-558350
10.643662
9.035913
-1.812497
other
Zn16Te8Br16O24
64
56
1,387.73
mp-687088
10.174421
9.600378
-1.996746
other
Co16Te8Br16O24
64
56
1,360.57
mp-1205048
8.39096
6.583005
-4.224
other
Ca4Mn8H32O48
92
56
1,088.82
mp-1196750
7.13518
7.203829
-3.961113
other
Pr4Se8N4O52
68
56
1,077.11
mp-637196
4.157267
2.28424
-3.228182
other
K8Pt4C16N16
44
56
904.96
mp-624762
6.089039
3.52929
-4.628345
other
Fe16Te8C44O44
112
56
1,921.23
mp-556343
13.570145
4.847424
-1.806963
other
Sr8Ga8B8O32
56
56
824.27
mp-1198619
7.731423
6.985026
-3.373141
other
V16Ag16I32O128
192
56
2,843.56
mp-1207709
7.62711
12.342586
1.310298
other
Y4Mn4Ga4O20
32
55
348.94
mp-555645
-1.463781
0.886341
-5.103101
other
Cu8Hg8S8Br8
32
55
772.5
mp-558188
10.64707
8.051847
-3.41862
other
Ag4Hg8As4O16
32
55
535.89
mp-1212075
1.230959
2.368789
-5.64292
other
K4Hg2H2Cl8
16
55
430.74
mp-1212488
11.779999
8.163741
-0.081732
other
Gd4Cr4Ge4O20
32
55
374.92
mp-655834
-4.590808
-2.369502
-4.016817
other
Mn8Sb8Se16Br8
40
55
1,163.43
mp-1195022
2.889527
2.794488
-4.400132
other
U8P8Cl40O16
72
55
1,961.2
mp-769487
12.578161
13.01298
-0.376378
other
Li8Ti8V10O36
62
55
690.31
mp-616515
7.994763
13.106685
-0.779892
other
Mn4Fe4Bi4O20
32
55
393.24
mp-557063
-3.673875
-4.269918
-4.225388
other
Sm14V2Se16O8
40
55
900.79
mp-558332
-0.620369
2.160199
-3.521468
other
K10Au2I4O4
20
55
586.8
mp-1191935
9.576406
2.140581
0.945253
other
Rb4V4O4F12
24
55
380.83
mp-1180943
1.913078
2.845711
-4.963289
other
K8Hg4Cl16O4
32
55
842.58
mp-757693
7.673425
5.470873
-6.944027
other
Li8Fe4C4O20
36
55
334.65
mp-649039
9.232114
11.108206
-0.126269
other
Ga4Fe4Bi4O18
30
55
395.71
mp-23567
-1.130958
0.954879
-5.413493
other
Cu8Hg8S8Cl8
32
55
745.22
mp-1214864
11.566847
7.920453
-0.244221
other
Al4Ga4Bi4O18
30
55
386.06
mp-770361
14.426972
9.041773
-1.794006
other
Li4V8B4O20
36
55
353.33
mp-21522
11.810651
7.238909
-2.749614
other
Fe4Ni8B4O20
36
55
349.93
mp-1204233
6.650919
6.805527
-3.582377
other
Mn4Zn4Br16O24
48
55
1,073.87
mp-554184
13.947997
4.26924
-2.177824
other
Ho4Cu2B16O32
54
55
542.56
mp-1229040
9.245711
10.897647
0.390508
other
Al4Fe4Bi4O18
30
55
397.02
mp-556986
13.62113
4.501945
-1.725252
other
Er8B8Cl8O20
44
55
794.82
mp-1188386
8.611028
2.429339
-1.203577
other
Fe2Hg2O4F10
18
55
266.44
mp-1205220
-4.424499
-2.950991
-3.883434
other
In8Sb16Pb16Se52
92
55
2,592.16
mp-1210692
12.750398
6.242432
-2.827546
other
Mg8Fe4B4O20
36
55
354.45
mp-554053
13.559312
4.853317
-1.805897
other
Sr8Ga8B8O32
56
55
850.45
mp-1195406
-7.095161
-1.732913
6.589972
other
La4Mg4Al28Fe8
44
55
755.82
mp-554441
11.861263
8.582374
0.474239
other
Na2Ti4Ga10O24
40
55
456.59
mp-1229026
9.010328
11.421718
0.023624
other
Al4Fe4Bi4O18
30
55
401.32
mp-1207744
8.366976
12.906721
0.47165
other
Y4Mn4Cr4O20
32
55
364.26
mp-1207564
6.079728
11.925271
-0.947082
other
Yb4Mn4Fe4O20
32
55
348.06
mp-1199036
10.550751
11.04123
2.62917
other
Nd4Ti4Cr4O20
32
55
392.57
mp-1228996
11.46365
7.951612
-0.366344
other
Al4Ga4Bi4O18
30
55
391.51
mp-540905
12.046956
7.283596
0.162037
other
Y4Al4Ge4O20
32
55
350.06
mp-505076
11.983119
7.006361
-2.706203
other
Ga4Ni8B4O20
36
55
332.32
mp-1196490
-3.115996
-2.242698
-5.698297
other
La16Cd16In8S52
92
55
2,124.81
mp-1207651
7.459696
12.72384
0.599322
other
Y4Mn4Fe4O20
32
55
368.61
mp-769512
9.044593
14.351556
-0.260322
other
Li8Ti8Mn10O36
62
55
697.09
mp-1201306
12.027481
5.668199
-3.287313
other
Ca8Mn8B16O52
84
55
906.69
mp-1212984
7.428397
12.695281
0.66803
other
Dy4Mn4Fe4O20
32
55
366.46
mp-861696
10.8684
13.490162
-0.069846
other
Li8Ti8Cr10O36
62
55
680.6
mp-1208812
11.84322
8.106373
-0.131072
other
Sm4Cr4Ge4O20
32
55
376.67
mp-559739
9.546053
2.021196
0.939911
other
Rb4V4O4F12
24
55
411.25
mp-1094074
14.181581
8.409209
-1.560942
other
Sc4Fe8B4O20
36
55
390.15
mp-1213032
7.557652
12.823393
0.586208
other
Er4Mn4Fe4O20
32
55
362.02
mp-766836
9.213566
14.032704
0.04525
other
Li8Ti10Mn8O36
62
55
701.53
mp-1213015
8.416265
13.034687
0.44733
other
Dy4Mn4Cr4O20
32
55
365.68
mp-1182524
9.598519
4.434448
-4.197486
other
Co4P4H48O36
92
55
1,146.64
mp-774947
6.664401
13.766145
-1.849725
other
Li8Ti4Co14O36
62
55
640.52
mp-556798
11.09414
7.617549
-4.009763
other
Ag4Hg8P4O16
32
55
526.94
mp-1204485
5.874856
5.30795
-3.802391
other
K16Rh6Br36O20
78
55
2,465.23
mp-1199278
11.604198
11.282813
-3.863155
other
Nd8Mo8Cl8O32
56
55
1,072.05
mp-1208423
11.880596
8.215946
-0.149654
other
Tb4Cr4Ge4O20
32
55
368.58
mp-1221879
8.221699
13.179476
-0.683975
other
Mn4Fe4Bi4O20
32
55
390.9
mp-554879
-1.448482
0.926873
-5.096057
other
Cu8Hg8S8Br8
32
55
793.78
mp-1219211
11.658306
8.358962
2.465037
other
Sm4U4Se6O8
22
55
421.89