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-863410
14.337749
7.530962
-5.3986
other
Li4Nb2P10O30
46
11
633.07
mp-863018
7.865042
0.132211
-4.497626
other
Si2H18C6Cl2
28
11
365.35
mp-1047854
14.692759
8.768
-5.541432
other
Ca2V6P6O26
40
11
505.37
mp-13292
-2.853739
-2.542734
-5.532687
other
Tb2Yb4Pr2S12
20
11
505.71
mp-1247002
-4.9003
-0.371953
-5.476796
other
Zr2Cr2Ag2S8
14
11
284.5
mp-1191204
8.71581
1.362516
0.92685
other
K4Ti2H2F14
22
11
345.63
mp-1337297
8.264172
11.035356
-0.796815
other
Zn4Cu2Sb2O12
20
11
218.86
mp-1041160
14.63215
8.081692
-4.243806
other
Ti6Zn2P6O26
40
11
513.92
mp-754479
14.002708
7.743289
-6.140244
other
Cr2Sb2P4O16
24
11
319.26
mp-1196773
14.059371
8.433898
-5.312636
other
Cs4Mo6P10O38
58
11
935.68
mp-1238505
9.052378
4.563706
-4.009302
other
K2Li4H6O6
18
11
251.98
mp-1041233
13.772205
6.934886
-5.682715
other
Zn2Sn6P6O26
40
11
601.27
mp-1209435
11.589561
9.109437
-5.126061
other
Rb2Mo6P4O28
40
11
605.34
mp-23945
9.111013
4.488352
-4.04879
other
K2Li4H6O6
18
11
229.82
mp-1323702
11.736753
10.509534
1.462948
other
Ta2Zn4Sb2O12
20
11
243.04
mp-570388
8.419839
0.716484
-4.38472
other
H16C4N2Cl2
24
11
233.54
mp-1047893
9.775187
8.198272
-6.492164
other
Ca2Co6P6O26
40
11
481.67
mp-669415
-4.579103
-3.327146
-3.598027
other
Ba6Bi12Pb2Se26
46
11
1,444.28
mp-567221
8.353518
0.656354
-4.453446
other
H20C6I2N2
30
11
333.54
mp-24589
9.395125
4.137122
-3.51052
other
K4H2Br2O2
10
11
240.85
mp-558826
8.673665
1.028571
1.751126
other
K2Ho2Be2F12
18
11
244.77
mp-557115
8.384864
1.634369
-0.110903
other
Cs4As4O2F20
30
11
564.74
mp-977417
8.693434
1.678577
-0.139441
other
Nd2B4H2F20
28
11
339.21
mp-1212430
-4.378855
-2.874834
-3.700214
other
K4Sb18Pb2Se30
54
11
1,611.37
mp-1191727
9.257054
7.88378
-2.552375
other
Na6H4Os2O12
24
11
295.78
mp-558801
1.150396
1.540712
-4.902885
other
K4Pr8Cl18O4
34
11
905.76
mp-1214727
6.645592
3.473725
-4.001003
other
Ca4C16S16O16
52
11
815.61
mp-9205
9.385185
6.768245
-3.289818
other
K2Se2O4F2
10
11
198.41
mp-1228475
6.295459
11.342472
0.426986
other
Ba10Mn2Co8O28
48
11
701.15
mp-1214212
11.358665
7.191921
-1.049812
other
Ca4Al6Si6O26
42
11
468.83
mp-504358
14.760046
7.92393
-5.499238
other
Li2Cr12P14O48
76
11
939.5
mp-1341170
11.788445
10.369673
0.473785
other
Ca4Sb2W2O12
20
11
273.22
mp-1201554
8.33898
7.850767
-2.415243
other
Ba2Yb12Si14O48
76
11
1,067.84
mp-6568
8.630665
3.621691
-7.014211
other
Ba2Ca2C4O12
20
11
279.26
mp-1012789
12.133422
8.332893
-7.678433
other
Li2Cr6P6O26
40
11
485.18
mp-1367927
7.69641
11.19805
1.407741
other
Ca4Ta2Ni2O12
20
11
237.49
mp-818591
10.935164
11.750256
-3.093605
other
Mn2V4Pb4O16
26
11
419.25
mp-752621
13.714521
4.516919
-2.568142
other
Li6Fe2B8O18
34
11
331.2
mp-697181
10.833132
4.197781
-3.87403
other
Cs2Li4H6O6
18
11
215.59
mp-863354
12.343579
7.625328
-7.152039
other
Co4Sn4P8O32
48
11
605.4
mp-734428
13.097452
5.898072
-7.255922
other
Rb4Ta4P14O48
70
11
1,083.3
mp-776006
12.710366
8.869807
-7.351549
other
V2Co2P4O16
24
11
289.13
mp-18873
6.802979
10.194333
-1.223996
other
Rb4Na2Mn2O8
16
11
275.72
mp-1201348
10.42414
3.961591
-4.486829
other
Th2H36S4O34
76
11
723.1
mp-1275594
10.511847
11.239035
-0.044167
other
Mg4Cr2Sb2O12
20
11
212.35
mp-1173919
6.353142
19.279705
-0.778232
other
Li4Mn2Co2O8
16
11
150.07
mp-755563
12.589226
7.465991
-7.342367
other
Ti4Ni4P8O32
48
11
574.75
mp-1212971
8.445085
1.878278
0.02946
other
Dy2Be2N2F12
18
11
266.72
mp-1047839
9.658906
8.228137
-6.589842
other
Zn2Co6P6O26
40
11
466.41
mp-17189
13.651505
6.337009
-5.312848
other
K6Ce2P4O16
28
11
417.72
mp-558810
8.463836
11.586516
2.132572
other
Ca8Ta4Mn4O24
40
11
487.62
mp-1209125
8.37144
1.215347
0.230848
other
Rb2Yb2Be2F12
18
11
266.43
mp-1041175
8.668977
7.921349
-4.889972
other
Zn2Ag6P6O26
40
11
543.58
mp-1173918
6.642777
18.738113
-0.737193
other
Li4Mn2Co2O8
16
11
148.28
mp-752710
14.028254
4.568349
-2.520151
other
Li6Cr2B8O18
34
11
328.37
mp-684052
14.014321
7.170697
-5.218633
other
Li2Sn12P14O48
76
11
1,173.45
mp-1047917
13.948595
9.028256
-2.80799
other
Zn2P6W6O26
40
11
566.62
mp-1041176
9.401084
7.748655
-5.886831
other
Zn2Cu6P6O26
40
11
460.34
mp-1572353
13.808953
13.098119
-0.752865
other
Li6V4O8F4
22
11
242.28
mp-557942
11.284403
7.721382
-7.460277
other
Sr2Fe6P6O26
40
11
511.96
mp-1200601
12.093886
9.079708
-5.175499
other
Mo6P4Pb2O28
40
11
558.69
mp-1301359
6.815447
14.524044
-1.503239
other
Li6Co4Ni2O12
24
11
204.72
mp-1211245
8.778403
1.00273
1.677138
other
K2Tm2Be2F12
18
11
238.88
mp-1239164
-5.523356
-0.230571
-5.704126
other
Nb2Cr6Cu4S16
28
11
487.95
mp-561096
-2.871671
-2.536216
-5.548095
other
Yb4Pr2Dy2S12
20
11
503.09
mp-725644
10.172046
7.615137
-2.515722
other
As2Pb4Cl4O6
16
11
359.25
mp-561470
4.550437
3.055872
-4.133391
other
Au2S10N10Cl8
30
11
742.82
mp-568011
-3.889965
-2.520999
-3.173782
other
K6P10Ru2Se20
38
11
1,069.88
mp-1199860
9.862997
8.721243
-4.035353
other
V4Co4Se4O22
34
11
464.38
mp-1188206
8.226829
6.545012
-5.215325
other
Cu2Pb2S2O12
18
11
258.51
mp-553924
10.650403
7.690436
-2.86374
other
Ag16P4I4O16
40
11
692.5
mp-17187
13.177588
5.593858
-5.849846
other
K6Nd2P4O16
28
11
419.74
mp-1041464
11.261712
7.903005
-7.47228
other
Mg2Fe6P6O26
40
11
483.08
mp-9344
-6.059663
-3.176006
-2.003786
other
Ti2Tl2Cu2Te6
12
11
336.21
mp-555271
8.703253
1.237149
1.568596
other
Ba4Zn4Cl2F14
24
11
400.02
mp-1346860
9.249012
12.880331
0.731565
other
Ta2Mn2Zn4O12
20
11
218.6
mp-1213271
8.440443
1.855331
0.228401
other
Er2Be2N2F12
18
11
257.04
mp-622558
11.259816
7.869142
-1.361279
other
Dy4Fe4Ge8O28
44
11
564.87
mp-1232525
11.468998
8.119946
2.710727
other
La4Cr4As4O4
16
11
318.58
mp-1194534
12.323313
7.382299
-0.650875
other
La6V2H6O16
30
11
385.07
mp-1195598
12.407937
6.534999
0.151528
other
Ba2Er8Si10O34
54
11
731.29
mp-723781
10.826439
5.913191
-4.99852
other
Mo2P2H6O14
24
11
290.96
mp-1041188
12.15265
6.572803
-5.730281
other
Zn2Bi6P6O26
40
11
653.14
mp-560478
12.461314
6.521197
0.053265
other
Ba2Y4Si6O20
32
11
435.4
mp-777412
13.38182
12.678025
-0.447833
other
Li8V4O8F4
24
11
222.75
mp-731713
10.049207
11.987715
-3.453794
other
Mn2V4Pb4O18
28
11
409.31
mp-558998
12.845472
6.32809
-0.866334
other
K8Cu4Si16O40
68
11
960.98
mp-731872
12.137592
7.192217
-0.895706
other
Mn2Al12Si8O38
60
11
629.85
mp-1374044
7.42455
9.804042
-0.374841
other
Ca4Ag2Sb2O12
20
11
267.73
mp-1366935
10.594436
9.746921
0.338932
other
Mg4Sn2Sb2O12
20
11
235.47
mp-6164
1.531811
2.025758
1.529272
other
Sr32Mo8N32O8
80
11
1,420.41
mp-19949
11.825782
7.378526
-0.70742
other
Sc4Cu4Ge8O26
42
11
546.71
mp-1342422
10.118392
9.574219
-0.236258
other
Zn4Bi2Sb2O12
20
11
253.67
mp-1195063
12.442952
6.516318
0.045285
other
Ba2Dy4Si6O20
32
11
446.64
mp-1579322
13.900454
7.717596
-6.23826
other
Cr2Sb2P4O16
24
11
316.16
mp-1214722
9.406585
1.68092
1.662912
other
Ba4Fe4Cl2F14
24
11
410.29
mp-554147
-2.511366
-0.294829
-5.17282
other
Rb4Nb4P4S22
34
11
952.22
mp-9510
-2.778905
-0.800117
-5.452713
other
Tl4P2Au2S8
16
11
432.72
mp-1181649
8.497172
5.395046
-5.344418
other
Cu2Pb2S2O12
18
11
271.28
mp-1373974
7.838965
10.820571
0.273527
other
Ca4Ni2Sb2O12
20
11
239.55