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-1205609
-6.722568
-0.731011
3.757024
other
Pr2P2Os4C2
10
63
156.75
mp-8153
12.397478
6.436071
-6.281482
other
Na2Hg2P2O8
14
63
187.5
mp-1205551
-6.299312
-0.505693
4.224748
other
Pr2Si2Ru4C2
10
63
160.11
mp-574448
-4.395891
-3.991304
-3.865105
other
Rb2Gd4Cu2Se8
16
63
438.69
mp-579556
-5.960248
-3.634992
-1.943817
other
Cs2Ho2Zn2Te6
12
63
452.05
mp-11605
-2.76573
-2.625689
-5.779585
other
K2Tb4Cu2S8
16
63
371.38
mp-1205640
-6.823031
-0.721424
3.888081
other
Tb2P2Os4C2
10
63
150.66
mp-1213649
-4.755934
-3.4592
-3.604021
other
Cs2Ho2Mn2Se6
12
63
378.67
mp-7211
-4.840245
-3.296976
-3.678773
other
Cs2Pr2Hg2Se6
12
63
416.8
mp-11116
-4.754014
-3.474338
-3.708548
other
Cs2Y2Cd2Se6
12
63
396.24
mp-1188571
8.342356
1.050653
1.197333
other
Cs4Ti2O2F10
18
63
400.47
mp-1206739
-6.991412
0.362817
4.640333
other
Er2Fe4Si2C2
10
63
130.1
mp-552806
9.306007
8.161965
-0.391961
other
Ba2Bi2Cl2O4
10
63
232.14
mp-1202623
9.86562
10.667595
3.370311
other
Ba2La4Ti6O20
32
63
436.31
mp-1207148
-6.965463
0.353631
4.708792
other
Ho2Fe4Si2C2
10
63
131.38
mp-731832
8.979746
1.546998
-0.134824
other
Cs4V2O4F8
18
63
356.81
mp-1209991
8.633465
1.121838
1.840671
other
Na2Li2Lu4F16
24
63
299.36
mp-19107
11.500409
12.776006
-2.861234
other
Li2Mn2V2O8
14
63
155.97
mp-1205718
-6.567809
-1.036724
4.034749
other
La2Si2Os4C2
10
63
162.96
mp-1202882
5.410087
-0.448074
-3.028077
other
Na2Yb2B8H32
44
63
511.22
mp-1195647
5.397481
-0.454987
-3.028247
other
Na2Y2B8H32
44
63
496.5
mp-561685
-3.390837
-2.033724
-5.215666
other
Cs2Yb2Co2S6
12
63
337.47
mp-1190370
-6.061312
-3.612523
-1.875255
other
Cs2Nd4Ag6Te10
22
63
731.86
mp-560791
10.421995
9.781207
1.027783
other
Cs2Na2Ti2O6
12
63
196.29
mp-1211756
7.941998
6.500344
-5.266032
other
K2Al2C2O10
16
63
236.41
mp-755613
8.266912
3.022177
-1.619402
other
Li2Ti2O8F6
18
63
268.05
mp-19302
10.802121
12.214108
-3.258036
other
Na2Ca2V2O8
14
63
202.82
mp-1190472
-6.107096
-3.571997
-1.923529
other
Cs2Ho4Ag6Te10
22
63
714.2
mp-1213937
11.606651
12.782038
-0.241242
other
Cr10Cu2Ge4O24
40
63
441.71
mp-11123
-4.876726
-3.236005
-3.710514
other
Cs2Y2Hg2Se6
12
63
395.62
mp-1190502
-6.086914
-3.5463
-1.947438
other
Rb2Dy4Ag6Te10
22
63
691.19
mp-753929
10.525095
1.078201
1.554654
other
Li8Mn4O4F8
24
63
271.13
mp-1192275
-4.701458
-3.713824
-3.976048
other
K2Er4Cu6Se10
22
63
504.27
mp-557434
8.973971
1.525524
1.355946
other
Zr2Mn2Tl2F14
20
63
319.71
mp-23084
9.72646
8.128859
-1.146859
other
Bi2Pb2Cl2O4
10
63
204.96
mp-721856
8.456912
1.58367
-0.089822
other
K4Ti2O4F8
18
63
288.19
mp-643989
8.513128
3.346719
-5.782249
other
K2H2C2O4
10
63
145.37
mp-1104011
-5.935603
-3.707713
-1.89475
other
Cs2Gd2Cd2Te6
12
63
471.81
mp-12343
-5.928665
-3.691014
-1.914241
other
Cs2Sm2Zn2Te6
12
63
464.68
mp-1205793
-4.957365
-1.007179
3.671234
other
Nd2Re4Si2C2
10
63
162.73
mp-1102100
1.905653
2.368058
-3.550012
other
Hg2C2Br6N2
12
63
412.25
mp-1188475
1.753378
2.735682
-5.564164
other
Cs4Fe2Cl10O2
18
63
559.53
mp-12341
-5.917371
-3.690809
-1.901176
other
Cs2Pr2Zn2Te6
12
63
477.94
mp-554966
11.172888
10.844967
-1.415079
other
Na10Mo2N2O8
22
63
315.47
mp-1206269
-6.630954
-1.106542
4.051263
other
Er2Si2Os4C2
10
63
152.18
mp-552547
9.231843
8.066092
-0.280889
other
Sr2Bi2I2O4
10
63
240.24
mp-559123
2.858396
2.253364
2.076928
other
Y6Si6N6O12
30
63
399.34
mp-558673
10.647837
9.816541
-1.749533
other
Pb6W2Cl4O10
22
63
428.67
mp-571189
-4.693858
-2.597619
-3.569484
other
Na2Hf4Cu2Se10
18
63
431.04
mp-1205734
-5.013996
-1.028437
3.698426
other
Y2Re4Si2C2
10
63
158.17
mp-780857
10.282799
2.168522
1.130136
other
Li4V2O2F8
16
63
192.37
mp-699473
7.430278
0.751947
-3.948201
other
Li4B24H52O14
94
63
842.6
mp-753349
13.553781
8.391053
-0.68772
other
Li2Ti2Si2O8
14
63
142.31
mp-726760
8.936041
1.707802
-0.308171
other
Rb4V2O4F8
18
63
351
mp-1205583
-6.569049
-0.493847
4.468239
other
U2Mn4Si2C2
10
63
138.71
mp-1189152
7.889719
6.96503
-4.696825
other
Al2C2N2O10
16
63
250.26
mp-643288
3.710609
-0.240391
-2.594348
other
Cs2Li4H12N6
24
63
351.49
mp-1095403
-5.927622
-3.71368
-1.809582
other
Ba2Tb2Cu2Te6
12
63
381.61
mp-619206
-5.978772
-6.95996
3.561036
other
Sr2Ca4In4Ge2
12
63
424.34
mp-11604
-2.874496
-2.60754
-5.725502
other
K2Sm4Cu2S8
16
63
386.51
mp-12497
-5.950513
-3.72532
-1.893903
other
Cs2Sm2Cd2Te6
12
63
482.2
mp-574620
-4.682578
-3.562757
-3.717216
other
Cs2Y2Zn2Se6
12
63
374.12
mp-1206583
-5.013837
-0.88391
3.662493
other
Ce2Re4Si2C2
10
63
160.7
mp-755625
10.50423
12.165785
-3.238672
other
Li2V2Ni2O8
14
63
153.17
mp-569107
-5.968968
-3.633125
-1.939841
other
Cs2Er2Zn2Te6
12
63
441.78
mp-1213969
8.417805
1.220591
1.425659
other
Ca2Hf2Tl2F14
20
63
338.25
mp-1192137
-3.688702
-2.076271
-5.825071
other
Er4Tl2Cu6S10
22
63
440.55
mp-23906
8.769241
3.983191
-4.508367
other
Li2H12N2O12
28
63
267.1
mp-1105612
-4.366616
-3.624744
-3.287661
other
Cs2Sc2U2Se10
16
63
483.42
mp-1210003
8.567127
1.110492
1.870203
other
Na2Li2Ho4F16
24
63
306.98
mp-16559
-4.335439
-4.12023
-3.880716
other
K2Ho4Cu2Se8
16
63
412.3
mp-6622
9.981344
10.661531
3.413279
other
Ba2Nd4Ti6O20
32
63
430.53
mp-554948
7.856993
6.44165
-3.432106
other
Na2I2O4F4
12
63
198.43
mp-1208232
-6.771324
-1.118862
4.15961
other
Th2Si2Os4C2
10
63
161.49
mp-1190985
5.609757
3.293795
-4.579912
other
Tc2C10I2O10
24
63
484.42
mp-777563
8.418736
1.038611
-4.250777
other
Ta4H30N12Cl14
60
63
842.05
mp-561722
-3.361374
-2.136648
-5.527388
other
Cs2Tm2Co2S6
12
63
316.64
mp-1205654
-6.362978
-0.438292
4.238292
other
Ce2Si2Ru4C2
10
63
155.9
mp-1192557
-4.702365
-5.309654
0.550974
other
Ba8Li4Cd6As12
30
63
836.19
mp-569892
0.21731
1.605033
-2.756343
other
Ca18B4C8Cl16
46
63
946.6
mp-11014
8.543165
1.54398
0.235134
other
K4Te2O2F8
16
63
309.26
mp-1205704
-5.588019
-0.608356
2.199162
other
Ho2P2Ru4C2
10
63
147.18
mp-561423
8.539227
1.421526
1.160848
other
Zr2Tl2Cd2F14
20
63
340.25
mp-1213646
-4.631142
-3.573711
-3.679372
other
Cs2Y2Mn2Se6
12
63
381.41
mp-12495
-5.997157
-3.692716
-1.914323
other
Cs2Tb2Cd2Te6
12
63
472.32
mp-1207684
-5.889541
0.097688
4.221675
other
Tm2Mn4Si2C2
10
63
134.45
mp-510462
-5.944692
-3.640005
-1.924434
other
Cs2Dy2Zn2Te6
12
63
442.08
mp-574426
-4.515667
-3.65525
-3.616007
other
Cs2Ce2Cd2Se6
12
63
416.15
mp-16445
-4.449235
-4.052028
-3.822049
other
Cs2Sm4Cu2Se8
16
63
462.14
mp-1209253
8.425727
1.149201
1.465363
other
Rb2Ca2Hf2F14
20
63
322.36
mp-6647
-4.592694
-3.527628
-3.826907
other
Ba2Y2Ag2Se6
12
63
333.19
mp-1189074
8.538383
1.001814
0.486203
other
Rb4Al2O2F10
18
63
307.98
mp-10337
-5.902536
-3.775687
-1.724776
other
Ba2Y2Ag2Te6
12
63
397.66
mp-1205622
-5.674011
-0.681038
2.20121
other
Y2P2Ru4C2
10
63
148.65
mp-558514
8.477898
1.246867
1.192899
other
Rb2Zr2Cd2F14
20
63
340.59
mp-552234
9.285789
8.13093
-0.355714
other
Sr2Bi2Br2O4
10
63
221.42
mp-1205614
-5.931324
-0.121221
4.310236
other
Th2Mn4Si2C2
10
63
146.49
mp-7151
-4.450093
-3.503425
-3.33124
other
Cs2U2Cu2Se6
12
63
359.5
mp-616468
5.710007
3.30323
-4.552583
other
Re2C10I2O10
24
63
473.99
mp-557563
10.527745
9.49333
-2.292483
other
Mo2Pb6Cl4O10
22
63
426.08