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-706455
4.155307
2.899868
-3.978127
other
As16S44N48Cl56
164
114
4,580.44
mp-1210400
8.729044
1.263286
1.056197
other
Na6Li2Ti4F24
36
114
507.07
mp-1195344
-4.619467
-3.1626
-3.813437
other
Ba8Ga8Sn2Se24
42
114
1,285.2
mp-1192523
7.543165
4.810832
-4.667513
other
Ag4S2N8O8
22
114
333.63
mp-1200793
-3.640985
-1.608299
-5.722188
other
Ga8Ge2Pb8S24
42
114
1,025.24
mp-1200063
12.449103
7.28267
-7.2286
other
K8Fe8P10O40
66
114
957.86
mp-27067
14.527817
8.32557
-5.267219
other
Li14Mo8P18O64
104
114
1,294.31
mp-1329473
12.68839
6.553112
-1.187921
other
Ca2Cr4Si16O40
62
114
848.05
mp-27087
14.520769
8.352808
-6.75419
other
Li14V8P18O64
104
114
1,227.14
mp-6702
13.31263
5.434258
-6.955467
other
Na14In8P18O64
104
114
1,409.05
mp-1201367
8.123072
4.580634
-6.806459
other
Na10Sc2C8O28
48
114
643.98
mp-27081
11.760394
7.655931
-7.691523
other
Li14Fe8P18O64
104
114
1,231.06
mp-705371
10.540037
8.14476
-6.924843
other
Li6Cr8P18O64
96
114
1,186.56
mp-705002
12.422151
9.036914
-7.724523
other
Li6V8P18O64
96
114
1,204.53
mp-705341
13.609592
8.603575
-6.059138
other
Li6Mo8P18O64
96
114
1,272.98
mp-1193718
1.993096
2.434527
-3.551116
other
Cu8Br12N8O2
30
114
732.37
mp-1204426
6.31538
1.98905
-1.483832
other
Eu32C16N32F40
120
114
1,708.25
mp-1020724
13.570364
5.630406
-6.937053
other
Na14Al8P18O64
104
114
1,206.18
mp-1198339
7.840311
0.508469
-4.473815
other
Si2H16C8Br8
34
114
621.17
mp-653248
14.352417
5.310612
-2.252941
other
Cr24B56Cl8O104
192
114
1,863.5
mp-698357
7.738113
0.505453
-4.487492
other
Sn2H16C8I8
34
114
716.19
mp-1204600
8.736403
7.932914
-3.312284
other
K6Ti8Ge6O40
60
117
998.77
mp-1221994
10.529119
9.510427
-2.019789
other
Mn6Cu2Te16O40
64
117
1,041.49
mp-1202424
2.552825
2.110877
1.68941
other
Li10La10Si8N24
52
117
686.92
mp-1205196
2.364595
2.066049
1.810223
other
Li10Ce10Si8N24
52
117
663.21
mp-1181100
6.525281
5.532595
-4.315089
other
Ir2S4Cl6O14
26
11
920.71
mp-756346
14.354619
8.676555
-4.70843
other
Fe2P4W2O16
24
11
308.3
mp-1209390
8.236673
6.37435
-5.38538
other
Pr2S4N2O16
24
11
361.34
mp-1013874
14.58764
7.852753
-4.836723
other
Na2Ti6P6O26
40
11
508.85
mp-12924
-3.17868
-1.87924
-5.732051
other
K2La2Si2S8
14
11
374.09
mp-1012678
14.14155
8.950206
-4.271029
other
Na2Mo6P6O26
40
11
549.25
mp-1080792
1.972385
2.886587
-4.755
other
K2I2Cl4O2
10
11
305.22
mp-585354
14.666387
7.759404
-5.767785
other
Li2Cr4P6O20
32
11
381.05
mp-1238830
-5.180657
-0.071391
-5.393176
other
Ti2Cr2Cu2S8
14
11
224.6
mp-1211551
8.631257
1.049987
1.73107
other
K2Dy2Be2F12
18
11
246.89
mp-1221451
13.725832
4.480278
-1.98842
other
Na4Al4B4O14
26
11
320.94
mp-10476
11.41469
3.931082
-7.574917
other
Na2Er2S4O16
24
11
320.43
mp-1210107
2.691624
3.045687
-4.251826
other
Re4Ru4N20Cl28
56
11
1,510.83
mp-1176429
13.409007
8.774238
-7.650941
other
Mn2V2P4O16
24
11
294.93
mp-867219
-5.846117
-6.057822
3.505516
other
Sr4Ga2Ge2N2
10
11
238.68
mp-570453
1.568705
2.076786
1.084468
other
Ba8W2N8Cl4
22
11
569.24
mp-1373336
12.274564
10.844006
0.685673
other
Mg4Ta2Mo2O12
20
11
225.94
mp-1041468
13.451877
8.182703
-7.051779
other
Zn2Cr6P6O26
40
11
474.52
mp-1041203
13.80175
7.381147
-5.206112
other
Ca2Sb6P6O26
40
11
625.22
mp-1193850
10.134539
7.21564
-5.51119
other
Ca4Al2P4O18
28
11
332.03
mp-867419
-3.157897
-1.320228
-5.279278
other
K2Eu2As2S8
14
11
397.37
mp-568157
8.423231
0.726215
-4.37675
other
H16C4Br2N2
24
11
252.44
mp-643259
11.045214
3.969946
-3.777792
other
Li8H6Cl2O6
22
11
263.08
mp-17664
12.316669
7.44557
-7.237368
other
Li2Ni4P6O20
32
11
349.75
mp-1095529
10.936921
3.970148
-3.319549
other
Lu2H4Cl2O4
12
11
132.98
mp-1374534
10.100264
9.438598
0.100308
other
Mg4Bi2Sb2O12
20
11
253
mp-1047803
11.076061
8.155716
-8.012611
other
Mn6Zn2P6O26
40
11
486.99
mp-16185
13.962246
7.627025
-7.070426
other
Mn12Ag2P14O48
76
11
936.7
mp-1201167
8.887144
0.633546
0.794064
other
Cs4Zr2Cu6F24
36
11
596.69
mp-1218597
7.257158
11.885177
2.030279
other
Sr4Y2Mn4O14
24
11
304
mp-1208155
-3.922355
-1.388236
-5.805222
other
Tl2In8S10Cl2
22
11
553.56
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