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-25967
12.353845
7.438958
-7.429737
other
Li6Ni6P6O24
42
159
447.88
mp-31940
14.237522
7.408265
-7.096617
other
Li6Mn6P6O24
42
159
483.79
mp-1204157
7.908283
6.653998
-4.929867
other
Ag6S6N6O18
36
159
527.65
mp-764661
6.080294
13.455431
-1.628049
other
Li6Co2Ni6O16
30
159
260.53
mp-780808
12.65853
12.71583
-0.743409
other
Li4V6Te2O16
28
159
313.38
mp-1176733
8.582373
3.795152
-7.181329
other
Li2Fe4C4O14
24
159
328.21
mp-1215006
10.207491
8.086583
-3.18358
other
Ag16Hg2As4O20
42
159
716.36
mp-757962
12.747102
7.726617
-7.394472
other
Li6Co6P6O24
42
159
484.38
mp-26725
14.099341
7.217883
-5.247342
other
Li6Sn6P6O24
42
159
563.38
mp-1193964
8.607308
3.722696
-7.06202
other
Ca4Mg2C6O18
30
159
349.72
mp-572886
14.114644
8.598774
-4.736433
other
Cs6Mo10P14O48
78
159
1,307.71
mp-554970
11.008972
11.072845
-2.357287
other
Rb4Te2W6O24
36
159
593.71
mp-863062
11.90744
6.897147
-1.21563
other
Li2Si2Bi2O8
14
159
199.88
mp-757941
12.155016
7.537403
-7.440495
other
Li6Ni6P6O24
42
159
474.8
mp-1213488
0.475219
3.632681
-5.098601
other
Cs4W12I12Cl16
44
159
1,606.93
mp-1213398
0.29335
3.587108
-4.814803
other
Cs4Mo12I12Cl16
44
159
1,654.53
mp-9480
12.938019
6.206534
-0.353908
other
K2Al2Si2O8
14
159
209.8
mp-752718
11.303732
7.58773
-2.401277
other
Li6Fe6Si6O24
42
159
468.67
mp-757322
14.870461
8.551439
-4.094435
other
Li6V6P6O24
42
159
478.44
mp-763186
8.938508
14.506817
-0.703333
other
Li4Mn6Sb2O16
28
159
308.65
mp-6783
10.362831
4.20767
-7.223678
other
Na6Li6S6O24
42
159
520.38
mp-1201314
11.408811
6.880836
-6.450823
other
Li16Be12P14O58
100
159
1,106.34
mp-777896
11.577893
13.501401
-1.424056
other
Li4V6Ni2O16
28
159
290.3
mp-570021
-4.537323
-2.106937
-3.364084
other
Ti12Tl10Ag2Se54
78
159
2,178.53
mp-16000
-4.640111
-2.223294
-3.316615
other
Cs10Ti12Ag2Se54
78
159
2,431.75
mp-16001
-4.610781
-2.09358
-3.325824
other
Rb10Ti12Ag2Se54
78
159
2,213.58
mp-1198202
8.588695
9.944245
-3.31319
other
Mg16Si2W18O98
134
159
2,302.98
mp-1198599
12.845826
6.396928
-0.751904
other
Ba6Ti6Si18O54
84
159
1,158.58
mp-2713741
14.076854
5.53364
-7.724501
other
Mg2Ta10P18O72
102
158
1,494.42
mp-1426023
11.728269
12.236314
1.373324
other
Mn4Nb4Zn4O18
30
158
357.52
mp-2713918
11.743432
4.109764
-8.095285
other
Mg8Ta4S18O72
102
158
1,460.92
mp-558769
8.613988
1.212229
1.624635
other
Na6Li8Th12F62
88
158
1,157.28
mp-761029
10.780531
8.90086
-7.386317
other
Li6V6P16O58
86
158
1,178.77
mp-2713985
14.013372
5.525001
-7.73694
other
Ta10Zn2P18O72
102
158
1,502.12
mp-2713744
11.74497
4.075332
-8.109619
other
Mg8Nb4S18O72
102
158
1,475.54
mp-2713821
13.963881
5.500472
-7.697858
other
Nb10Zn2P18O72
102
158
1,519.47
mp-1228245
9.857675
10.443547
3.384296
other
Ba2La8Ti8O30
48
158
623.81
mp-1366855
9.76335
13.127638
0.270801
other
Mn4Nb4Zn2O18
28
158
336.84
mp-2713921
14.013446
5.421118
-7.699365
other
Ca2Nb10P18O72
102
158
1,557.41
mp-1221458
8.979922
1.789062
1.793555
other
Na4Np12Fe4F60
80
158
1,102.33
mp-2713885
13.996798
5.458478
-7.714069
other
Mg2Nb10P18O72
102
158
1,518.93
mp-1223414
10.412428
9.467368
-2.080893
other
La4Te12W2O36
54
158
852.76
mp-2713766
11.395452
4.198579
-7.860793
other
Ta4Zn8S18O72
102
158
1,483.8
mp-557349
11.727283
12.36922
1.101901
other
Mn6Nb4Zn2O18
30
158
346.8
mp-2713764
11.692459
3.908744
-7.976901
other
Ca8Nb4S18O72
102
158
1,720.85
mp-1176896
12.695082
8.715979
-7.93117
other
Li12V6P16O58
92
158
1,181.16
mp-2713968
11.386892
4.146315
-7.886373
other
Nb4Zn8S18O72
102
158
1,490.17
mp-2713941
11.73638
3.964415
-7.971277
other
Ca8Ta4S18O72
102
158
1,698.9
mp-2713900
14.112336
5.487035
-7.728126
other
Ca2Ta10P18O72
102
158
1,541.31
mp-2241088
8.81449
10.098678
-1.179224
other
K6Mg1Cr2O8
17
16
351.86
mp-2227380
-4.55556
-0.620257
-5.459499
other
Mg1Cu2W1S4
8
16
180.25
mp-1222221
7.579228
6.60314
-3.002514
other
Nd6Pb6I26O80
118
161
2,004.31
mp-2713749
11.442676
4.163077
-8.000156
other
Ti6Zn6S18O72
102
161
1,436.28
mp-558757
11.606293
11.040634
-3.776693
other
La8Cu12Mo18O72
110
161
1,679.66
mp-1220868
13.007824
6.084503
-0.605445
other
Na6Al6Si6O24
42
161
800.04
mp-767248
11.819184
7.266332
-2.029567
other
Li6Fe6Si6O24
42
161
722.36
mp-2713909
14.425343
5.328587
-7.812819
other
Hf6Nb6P18O72
102
161
1,552.68
mp-555221
10.983489
12.123055
-3.243798
other
Sr18Tm2V14O56
90
161
1,499.73
mp-560257
13.306382
5.513419
-6.302058
other
Ca18Cr2P14O56
90
161
1,178.36
mp-729204
7.910554
6.629794
-4.919409
other
In2S6N6O24
38
161
698.9
mp-1204305
8.418093
6.923502
-5.036144
other
Na6Zn8P6O38
58
161
867.71
mp-1044382
9.760818
7.88656
-6.056838
other
Ti2Cr2P6O24
34
161
464.96
mp-734398
12.994988
5.589419
-6.503806
other
Ca18Mn2P14O56
90
161
1,187.1
mp-1221186
8.636012
7.08896
-5.347582
other
Na6Zn6P6O32
50
161
741.21
mp-1221304
9.698099
7.090657
-2.920739
other
Na6Al6Si6O32
50
161
727.95
mp-1216943
13.846181
5.618669
-7.721292
other
Ti2Nb2P6O24
34
161
488.39
mp-1216456
-4.529808
-1.232915
-5.532895
other
V2Cu24As6S32
64
161
1,185.71
mp-554104
12.979279
5.643416
-6.423171
other
Ca18Fe2P14O56
90
161
1,180.38
mp-1044343
13.130203
7.959116
-6.451469
other
Ti2P6W2O24
34
161
479.95
mp-17864
13.824537
4.134122
-2.270447
other
Ba2Na2B18O30
52
161
619.68
mp-673024
13.870088
7.006424
-5.288602
other
Li2Sn8P6O24
40
161
684.79
mp-556300
14.256866
5.161336
-2.161255
other
Fe6B14Cl2O26
48
161
467.83
mp-1199988
6.422676
8.718603
-2.449356
other
Al2Pb6S2O22
32
161
446.93
mp-6226
13.854376
6.901075
-5.325426
other
Na2Sn8P6O24
40
161
698.25
mp-17672
13.811073
4.170351
-2.323602
other
Ba2Li2B18O30
52
161
593.47
mp-1043735
13.83707
5.660232
-7.734412
other
Ta2Ti2P6O24
34
161
481.52
mp-2713729
11.597079
4.149977
-8.046547
other
Mg6Sn6S18O72
102
161
1,472.59
mp-6755
13.820122
6.853185
-5.373951
other
K2Sn8P6O24
40
161
738.48
mp-558862
14.065168
6.876241
-5.22415
other
Na2Ge8P6O24
40
161
649.19
mp-1216191
13.508338
4.848224
-2.57567
other
Zn12B6H2O22
42
161
524.78
mp-555661
13.365314
5.345584
-6.356455
other
Ca18In2P14O56
90
161
1,199.94
mp-1217182
-2.767874
0.522567
-3.484786
other
Tl10Re12Se16Cl14
52
161
1,401.72
mp-780573
12.75373
5.755624
-6.487518
other
Ca18Co2P14O56
90
161
1,178.47
mp-6476
10.192008
7.812232
-3.079535
other
Ag6Se2N2O6
16
161
255.26
mp-543040
10.845149
5.175832
-4.302619
other
Ga4Te6H12O24
46
161
531.76
mp-1199407
7.677546
4.821388
-5.439877
other
Mg12C6Cl6O36
60
161
1,142.92
mp-1105495
13.517118
4.493698
-1.744904
other
Ba2Hf2B4O12
20
161
267.61
mp-1228296
-2.609369
0.647863
-3.98603
other
Cs10Re12S16Cl14
52
161
1,614.29
mp-1182709
7.246146
6.955046
-4.264467
other
Ca12As8P2O70
92
161
1,371.19
mp-1202534
13.27406
5.388083
-6.227939
other
Ca20Ag2P14O56
92
161
1,209.74
mp-2713802
11.566134
4.143065
-8.036318
other
Mg6Ti6S18O72
102
161
1,421.03
mp-1228209
12.930917
6.169223
-0.566032
other
Al6Tl6Si6O24
42
161
746.42
mp-555068
10.962604
12.138484
-3.251184
other
Sr18Lu2V14O56
90
161
1,496.35
mp-2713880
11.421526
4.155882
-7.896547
other
Ca6Sn6S18O72
102
161
1,620.32
mp-780609
13.003603
5.595109
-6.487889
other
Ca18Mn2P14O56
90
161
1,180.85
mp-1044267
10.68487
8.662529
-7.255764
other
Ti2V2P6O24
34
161
460.21
mp-559500
11.161016
11.853082
-2.211609
other
Na6V2S2O6
16
161
268.24
mp-2714000
13.698988
5.545394
-7.638264
other
Ta6Sn6P18O72
102
161
1,500.21
mp-1228567
9.26183
1.263963
1.432005
other
Ba4Na2Mn6F22
34
161
524.18
mp-2713884
12.018591
4.053036
-8.174701
other
Hf6Mg6S18O72
102
161
1,500.74