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-1043454
12.582405
7.948887
-0.886408
other
Mg2Mn2Ge4O12
20
15
237.41
mp-17439
13.196006
6.018056
-6.661209
other
K2Sm2P8O24
36
15
512.09
mp-1209193
5.470886
5.33606
-3.958894
other
Sr2Pb4Br12O10
28
15
756.65
mp-769533
11.8961
7.658386
-7.708585
other
Li2Mn2P8O24
36
15
465.91
mp-1040917
14.59631
7.789865
-5.378784
other
Ca4Fe8P8O32
52
15
661.64
mp-753876
10.850205
7.611531
-2.509959
other
Li2Co2Si4O12
20
15
212.69
mp-1214914
7.069907
4.632205
-5.231741
other
Ba2H4C8O16
30
15
489.8
mp-1213209
10.815355
11.378399
-1.974547
other
Cs2Tm2W4O16
24
15
336.76
mp-1195621
13.429792
6.75172
-0.602923
other
Rb8U4Si24O60
96
15
1,560.44
mp-622183
11.940616
7.849418
-6.730978
other
Co8P4Cl4O16
32
15
427.88
mp-14355
12.989215
5.710891
-5.930433
other
Cs4Sr2P4O14
24
15
434.24
mp-1301329
9.103565
14.432882
-0.113814
other
Li4Ti4Mn4O16
28
15
307.18
mp-1648716
9.489642
14.463432
-0.169206
other
Li12Mn10Sb2O24
48
15
523.63
mp-557275
12.300953
6.884528
-1.280817
other
Ca6Mn4Si8O28
46
15
565.63
mp-1205046
3.550784
3.319833
-3.891572
other
Co4Br10N18O4
36
15
789.25
mp-760468
12.579451
6.704618
-0.943803
other
Li2Si4Bi2O12
20
15
262.42
mp-1359749
12.686256
7.179553
-6.997138
other
Zn2Cu2P8O24
36
15
440.3
mp-12326
11.834961
7.385397
-0.821881
other
Ca2Zn2Ge4O12
20
15
249.71
mp-1019781
13.130506
5.484977
-6.40382
other
K4Na6P6O20
36
15
536.07
mp-558408
-5.341822
-2.125696
-1.773391
other
Nb8Te18I8O2
36
15
1,284.75
mp-759263
12.569063
6.550419
-6.146849
other
Li6Bi6P8O32
52
15
665.96
mp-1190484
12.072825
4.746498
-5.030549
other
Y2P2H8O12
24
15
238.44
mp-541495
13.232379
6.076767
-6.697478
other
K2Y2P8O24
36
15
490.26
mp-1180393
8.510983
6.052961
-5.800276
other
Na8Hf2S8O36
54
15
817.3
mp-696407
9.785561
4.170129
-4.306774
other
Mg4H48S4O40
96
15
1,156.13
mp-1208737
11.473629
11.11307
-3.97832
other
Tb4Hf4Mo14O56
78
15
1,351.9
mp-1204722
7.950829
4.56084
-6.226194
other
Ba4Zr2C16O38
60
15
1,119.04
mp-1180605
7.421138
7.075608
-4.2971
other
Na2Al2S4O38
46
15
775.3
mp-680836
-5.447494
-2.264067
-1.683219
other
Ta8Te18I8O2
36
15
1,242.91
mp-561398
11.184275
11.118123
-3.934507
other
Na2Al2Mo4O16
24
15
357.39
mp-1182478
10.492398
6.929699
-2.346773
other
Ca4Al8Si8O42
62
15
894.39
mp-644265
8.589607
3.412132
-5.864352
other
Cd4H8C8O16
36
15
446.17
mp-1213222
12.648855
7.10455
-6.389803
other
Cu2Ag4P8O24
38
15
517.11
mp-1046733
8.441209
8.219868
-2.987187
other
Ca2Fe2Si2O10
16
15
186.6
mp-753183
10.508637
4.198598
-5.253814
other
Ca2H8S2O12
24
15
258.14
mp-1210415
12.221563
11.218131
-2.009815
other
Na6Sc4Mo6O24
40
15
576.24
mp-1211755
13.665451
7.060793
-0.584855
other
K2Al4Si8O22
36
15
505.1
mp-758655
8.458241
0.76944
-4.402605
other
H32C8Br4N4
48
15
535.77
mp-567890
0.675095
1.905339
-5.020363
other
Ag6Hg18As12Cl18
54
15
1,490.53
mp-1190524
-3.736824
-1.493174
-5.748882
other
Tl4In4Hg4S12
24
15
605.88
mp-1213796
12.8406
7.832695
-6.743327
other
Co8P4O16F4
32
15
366.71
mp-1218264
7.355472
11.984681
2.013885
other
Sr2Pr4Mn6O18
30
15
362.4
mp-753004
10.826088
11.102695
0.109093
other
Li12Mn2O4F8
26
15
312.04
mp-1204687
11.790604
6.752808
-6.446997
other
Cu12P8H8O36
64
15
666.12
mp-556804
13.793556
4.574075
-1.960835
other
Pr2Al6B8O24
40
15
379.98
mp-1046569
12.597755
12.14215
-0.577448
other
Mg8V10Te6O36
60
15
730.59
mp-1195703
-2.473412
-0.528342
-5.333824
other
Rb8Ge2P8S24
42
15
1,230.64
mp-554657
13.815069
4.167818
-2.327999
other
Na4Tl4B20O34
62
15
774.48
mp-561126
-2.887763
-2.267777
-5.914291
other
Nd6Si4S16I2
28
15
679.25
mp-1192188
10.882104
11.40083
-2.036545
other
K2Ho2W4O16
24
15
327.1
mp-1041071
12.620662
7.644317
-7.074697
other
Mg4Co8P8O32
52
15
607.6
mp-1179087
6.576424
4.973069
-4.502923
other
Te2C4N8O16
30
15
537.79
mp-1208672
12.05187
7.536811
-1.155555
other
Sr4Co4Ge8O24
40
15
522.56
mp-24714
9.065343
3.453152
-5.680563
other
Zn2H8C4O12
26
15
261.78
mp-758742
8.303441
1.123819
-3.860329
other
K2Y2H16N8
28
15
326.6
mp-1213384
10.417873
6.768213
-2.743933
other
Eu6B4O12F6
28
15
349.11
mp-1207646
11.054218
11.386293
-2.086431
other
Y2Tl2W4O16
24
15
334.07
mp-1189341
-4.595904
-3.186301
-3.785471
other
Hf2Tl4Pb2Se8
16
15
466.23
mp-1182747
8.094752
6.453853
-4.773882
other
Ba4Zn2P12O56
74
15
1,334.35
mp-1177898
8.056977
15.481356
-0.546966
other
Li4Mn2Fe2O8
16
15
152.45
mp-554395
-3.528021
-1.30351
-5.64543
other
Na10Li6Ti4S16
36
15
760.6
mp-1189464
-4.585961
-3.135085
-3.830284
other
Zr2Tl4Pb2Se8
16
15
471.09
mp-1213191
10.888845
11.357292
-1.968423
other
Cs2Ho2W4O16
24
15
339.54
mp-1190874
8.602354
8.187407
-3.840253
other
Fe2Bi4P2O16
24
15
337.32
mp-707129
12.293878
4.153267
-3.203338
other
Ca6B12H32O40
90
15
755.53
mp-558381
2.489476
2.722816
-4.025544
other
Pt4C4I8O4
20
15
676.88
mp-1275845
12.241767
13.501512
-0.8865
other
Li6Mn2V6O16
30
15
300.28
mp-24297
11.71391
4.754313
-5.32656
other
Sr2P4H8O8
22
15
289.27
mp-1199659
10.027277
10.468436
-3.813125
other
Rb8Te2Mo12O48
70
15
1,185.82
mp-1045620
9.27806
0.667558
0.148475
other
Ba4Zn2Cu6F28
40
15
532.14
mp-1213324
10.839786
11.402133
-2.025577
other
Cs2Tb2W4O16
24
15
344.16
mp-1101593
8.849641
7.972225
-4.932181
other
Li2Fe4P6O24
36
15
459.69
mp-1214547
9.793173
1.988584
1.526925
other
Ba4Mn4V4F28
40
15
567.1
mp-560123
11.000786
10.886908
-3.060455
other
Fe2Bi6Mo4O24
36
15
516.88
mp-572404
7.962619
10.135796
-3.734464
other
Cs12Nd4Cr12O48
76
15
1,529.84
mp-1274983
9.010205
15.152299
-0.518911
other
Li4Mn8O12F4
28
15
316.3
mp-755467
11.434913
12.27372
-3.198404
other
Li2V4Ni2O12
20
15
248.66
mp-758208
11.315221
7.769115
-7.604482
other
Li4Fe4P8O28
44
15
519.89
mp-1040837
14.628821
8.00723
-5.397154
other
Zn4Cr8P8O32
52
15
645.23
mp-26205
13.340135
8.042871
-7.467464
other
Li6Cr6P8O32
52
15
635.16
mp-1211333
11.106483
11.28353
-2.021914
other
K2Sm2W4O16
24
15
326.69
mp-1214357
11.316216
11.070458
-3.901845
other
Ba2Y4Mo8O32
46
15
667.2
mp-555861
13.75777
5.018657
-6.711887
other
Na8Th4P8O32
52
15
640.12
mp-1200089
10.533118
7.542367
-4.388509
other
Ca4Zn8As8O34
54
15
752.81
mp-557786
14.137648
4.969571
-7.556048
other
Ca2Nb4P4O22
32
15
426.06
mp-1200744
13.831495
4.225841
-2.372483
other
Rb4Cd6B32O56
98
15
1,146.15
mp-1046688
8.514792
8.193733
-3.049598
other
Mg2Fe2Si2O10
16
15
173.16
mp-1046588
10.313351
11.601607
-0.967858
other
Mg8Mn10Te6O36
60
15
740.88
mp-1190646
7.728843
8.316656
-3.391966
other
K4Cu2Te2O14
22
15
363.24
mp-562517
12.850325
6.391517
-0.529945
other
Ca2Mg2Si4O12
20
15
256.82
mp-1045680
12.725931
7.027129
-7.016633
other
Ca2Cu2P8O24
36
15
482.77
mp-1197606
3.616336
2.754717
-3.51175
other
Hg4C6I14N18
42
15
1,324.57
mp-1105411
12.184099
8.054682
-1.046872
other
Li2Cr2Ge4O12
20
15
221.41
mp-1579309
14.066745
7.252668
-7.020626
other
Li4Mn2P4O14
24
15
300.18
mp-23779
10.245941
4.315078
-6.593098
other
K6H2S4O16
28
15
420.53
mp-559142
13.148557
6.18771
-6.594818
other
K8Li8P16O48
80
15
1,099.93
mp-1213151
11.023102
10.945549
-3.691625
other
Cs2La2Mo4O16
24
15
367.76
mp-772427
11.930608
7.543948
-7.796603
other
Li12Fe4P8O32
56
15
574.53
mp-1046306
10.234622
9.50367
-0.473017
other
Ca8Sn10Te6O36
60
15
970.81
mp-558583
6.946143
2.919227
-2.54833
other
As8S48N40F48
144
15
2,754.19