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-1045729
12.648748
7.086101
-7.161012
other
Mg2Cu2P8O24
36
15
440.57
mp-757960
12.404352
7.381664
-7.194804
other
Li4Ni4P4O16
28
15
365.34
mp-1218665
10.506241
11.593698
3.147405
other
Sr6Ta8Ti8O42
64
15
831.04
mp-1211126
10.655326
11.465245
-2.315911
other
Li2Sc2W4O16
24
15
284.64
mp-1045939
11.546387
11.149022
2.156849
other
Ta4Zn4Sn2O16
26
15
342.43
mp-557531
10.458244
4.952286
-6.228647
other
Pb4S2O8F4
18
15
272.32
mp-6479
13.196936
6.031782
-6.735046
other
K2Dy2P8O24
36
15
496.83
mp-758986
11.821896
7.734465
-7.731105
other
Li2Mn2P8O24
36
15
430.36
mp-1203302
11.126239
7.517323
-4.291293
other
Na28Cu16As20O80
144
15
1,900.18
mp-17349
13.297361
5.379404
-6.975877
other
Na6In4P6O24
40
15
500.53
mp-556185
10.481605
10.238077
1.465325
other
Rb2Na2Ti2O6
12
15
185.81
mp-1201325
6.22002
4.989548
-4.572006
other
Rb10Nd4N22O68
104
15
1,653.09
mp-555486
12.042059
6.933183
-7.072925
other
Li2Eu2P8O24
36
15
477.22
mp-1194050
-2.951108
-2.176149
-5.917227
other
Gd6Si4S16Br2
28
15
640.71
mp-1191034
-3.752718
-1.472275
-5.438583
other
Na4Cd4Sb4S12
24
15
576.53
mp-1201349
10.489113
4.069275
-4.999815
other
Pr4H32S6O40
82
15
875.71
mp-555541
6.513007
4.573215
-4.502501
other
K4C4N8O16
32
15
452.45
mp-770706
9.546004
13.103697
0.171806
other
Li12Mn2Al2O12
28
15
250.32
mp-1105143
11.759255
7.402449
-0.968436
other
Na2In2Ge4O12
20
15
251.91
mp-1214282
8.298918
6.14149
-4.40828
other
Ca2B4H4O16
26
15
265.4
mp-765076
11.371643
-0.307588
0.464387
other
Li4Mn4O4F8
20
15
218.03
mp-1197014
9.992634
3.053028
-3.925924
other
Sn4H24Cl12O14
54
15
835.72
mp-1205078
13.83139
6.661
-6.144122
other
Li2Ce2P8O24
36
15
480.47
mp-1045579
13.930917
6.849289
-5.741671
other
Ca2Sn2P8O24
36
15
559.7
mp-759620
11.34359
8.927773
-7.752318
other
Li8V6P16O58
88
15
1,171.05
mp-1154515
13.537167
8.467712
-0.724227
other
Mg2Ti2Si4O12
20
15
228.45
mp-765082
14.67246
8.676357
-3.726053
other
Li8V16P16O60
100
15
1,367.58
mp-1180744
6.923585
5.556585
-4.434422
other
Mg4Cu4C2O22
32
15
421.24
mp-558629
12.317478
6.397195
-0.303398
other
Ba4Zn2Si4O14
24
15
371.1
mp-555710
11.423937
11.020236
-3.699165
other
K10In2Mo8O32
52
15
845.85
mp-1176599
14.73239
8.040136
-4.247725
other
Li4Nb4P4O20
32
15
384.65
mp-1182967
7.169049
6.596582
-4.251991
other
Al2Cu4As2O24
32
15
472.15
mp-1213734
-0.828135
0.812389
-3.818265
other
Cs6Nb12S2Br34
54
15
1,639.03
mp-571268
-0.386828
1.362678
-4.280825
other
Cu6Hg18As12Br18
54
15
1,537.73
mp-704915
13.616019
4.395024
-2.534099
other
Na4Ni4B24O42
74
15
739.03
mp-778207
9.797604
4.650666
-4.964635
other
Mn4H32S8O48
92
15
989.84
mp-1195610
10.202949
3.154557
-3.89177
other
Ca4H52I8O26
90
15
1,208.59
mp-728777
8.802088
5.355281
-5.977892
other
Rb4S4N2O12
22
15
388.55
mp-758270
14.650402
7.565137
-5.284492
other
Li6Ti2P4O16
28
15
291.49
mp-1097997
11.070917
7.587628
-1.104756
other
K6Eu6Ge12O36
60
15
938
mp-559837
10.461696
9.388968
-1.650862
other
Bi4Te4W2O20
30
15
451.79
mp-1205333
12.04324
7.34834
-0.676857
other
Ca2Ti2Ge2O10
16
15
199.31
mp-1195305
-2.453468
-0.551484
-5.32887
other
K8Ge2P8S24
42
15
1,159.16
mp-1193210
9.737618
7.50636
-2.521407
other
Pb6Se4I4O12
26
15
583.11
mp-561467
-2.617394
-0.572419
-5.414834
other
Y2Ag6P4S16
28
15
637.33
mp-504307
14.488686
7.665546
-6.018898
other
Li4Cr4P4O16
28
15
430.72
mp-6066
12.374454
6.888916
-1.058137
other
Na2Ta2Ge2O10
16
15
214.34
mp-26896
10.481961
9.017101
-6.89352
other
Li2V2P4O16
24
15
287.91
mp-1199745
6.478706
5.98737
-3.659409
other
Ca4Cd2Br12O24
42
15
878.93
mp-1046360
11.532101
11.340793
1.58841
other
Ca8Ti10Te6O36
60
15
883.79
mp-25825
14.555165
8.133722
-5.055988
other
Li2Fe8P6O24
40
15
466.52
mp-15548
9.369096
0.56997
0.718769
other
Na16Zn8Fe8F56
88
15
1,176.39
mp-1232408
12.893954
5.827001
-6.432729
other
Cs6In6P8O32
52
15
860.89
mp-19043
13.730354
7.895465
-1.047387
other
Li2V2Si4O12
20
15
206.83
mp-17341
9.634573
9.417403
1.174336
other
Ba6Mn2Sb4O18
30
15
460.93
mp-1195975
11.818913
7.012465
-6.928962
other
Mn10P8H12O40
70
15
744.5
mp-1307565
10.301859
13.835644
-0.551714
other
Li4Cr6Sn2O16
28
15
313.05
mp-554817
9.268367
9.25234
1.450476
other
Ba6Ca2Sb4O18
30
15
484.26
mp-1176897
13.421453
8.548141
-7.793477
other
Li14V6P16O58
94
15
1,174.54
mp-727944
13.278576
6.374417
-1.092213
other
Na4Be4Si12O32
52
15
701.07
mp-1221301
9.32862
7.300448
-2.709547
other
Na4Zr2Si6O22
34
15
500.01
mp-696762
12.076209
4.905907
-5.096367
other
Tl2P4H10O16
32
15
391.6
mp-1177968
10.6435
12.59125
-0.025187
other
Li8Fe4Sn4O16
32
15
339.14
mp-1209239
10.779889
11.463773
-2.158077
other
Rb2Sc2W4O16
24
15
315.3
mp-18822
14.262519
7.85814
-6.956132
other
Mn8P4O16F4
32
15
398.28
mp-560830
11.981277
6.988274
0.649685
other
Nd6Si4Cl2O16
28
15
390.62
mp-1211997
8.536242
1.409495
-0.245681
other
K4Ga2O2F10
18
15
308.81
mp-1177915
11.182327
8.095469
-7.969117
other
Li4Mn6P10O36
56
15
766.07
mp-25847
9.539369
8.116914
-5.967235
other
Li6Ni4P6O24
40
15
419.48
mp-1177733
13.346965
7.868066
-7.575079
other
Li12Cr8P12O48
80
15
1,009.84
mp-22175
4.703889
2.68495
-3.499629
other
Eu2C4S4N4
14
15
267.61
mp-757831
12.800872
7.481259
-7.501788
other
Li8Co4P8O28
48
15
565.06
mp-758219
10.863606
3.893383
-4.307687
other
Ni2P4H32O20
58
15
549.17
mp-697709
9.144424
5.216707
-4.144886
other
V4Ni2H16O20
42
15
446.66
mp-1203469
-3.073949
-0.210494
-2.729741
other
In4Te18Ru2Cl16
40
15
1,335.91
mp-1180425
6.329031
5.843715
-3.829065
other
Mg2N2Cl6O12
22
15
446.63
mp-1196473
11.545878
11.022031
-3.691251
other
Tb4Sb4Mo8O36
52
15
850.5
mp-1210122
12.503714
7.797155
-4.730551
other
Na2Mn8As6O24
40
15
519
mp-1019520
2.119118
1.949861
1.487081
other
Ba6Ca4Si4N12
26
15
459.45
mp-1306526
7.750881
17.104811
-0.436525
other
Li6Mn4Co2O12
24
15
224.03
mp-773200
14.754963
6.150784
-1.961878
other
Li4V4B8O20
36
15
458.62
mp-555493
2.108548
2.673198
-4.471522
other
Re4S4N2Cl22
32
15
951.55
mp-1213304
10.928886
10.943256
-3.634812
other
Cs2Gd2Mo4O16
24
15
348.82
mp-639164
10.182837
9.674434
-2.022296
other
Co14Te8Br12O24
58
15
1,101.91
mp-573078
1.919229
2.946117
-4.503231
other
W4Se4S8Cl20
36
15
1,117.72
mp-554778
12.721488
6.427515
-0.305392
other
Na6Y6Si12O36
60
15
766.36
mp-704879
10.12812
9.555849
-1.977115
other
Ni10Te8Br4O24
46
15
733.74
mp-1209046
11.138773
10.570581
-2.706571
other
Sc2Bi6Mo4O24
36
15
526.7
mp-622203
9.258314
1.317389
1.244916
other
Ba4Mn4Ga4F28
40
15
561.6
mp-1218796
9.875468
9.719174
3.531888
other
Sr10La12Nb8O48
78
15
1,156.55
mp-643412
9.643913
5.639107
-4.307136
other
Mn4H8Se4O20
36
15
437.91
mp-1192273
6.560433
6.005342
-3.652997
other
Mg2N2Cl6O12
22
15
321.52
mp-1264233
12.554923
6.946913
-1.384254
other
Zn4Co4Si8O24
40
15
462.54
mp-1197401
13.566133
4.205746
-2.448666
other
K8B20H8O38
74
15
857.74
mp-759185
13.785585
7.046452
-6.178895
other
Li2Sb2P8O24
36
15
508.36
mp-1221309
11.751088
11.158553
-3.269038
other
Na4U2Mo6O24
36
15
488.45
mp-1209138
9.577326
11.085354
-2.783017
other
Rb2Yb2W4O16
24
15
340.92
mp-1195705
-2.492377
-0.575745
-5.274285
other
Cs8Ge2P8S24
42
15
1,306.53
mp-1191111
13.573655
5.562719
-7.165626
other
Sr2Ti2P4O16
24
15
321.4
mp-1101604
14.263562
7.417023
-6.562713
other
Li8Cr4P8O28
48
15
571.77