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-1101650
8.460858
5.736942
-7.298518
other
Na4Mn4P4C4O28
44
1
596.1
mp-768564
13.407503
8.391157
-7.969109
other
Li6Mn2V2P6O24
40
1
484.08
mp-774867
8.914785
4.930321
-7.757636
other
Na10Ni4P4C4O28
50
1
612.03
mp-2218440
10.492826
4.49324
-6.724224
other
K1Mg1Fe1S2O8
13
1
222.44
mp-2220594
11.132134
10.947765
-2.634959
other
Mg1Tl4V4Te4O20
33
1
539.98
mp-2217982
9.665722
8.849867
2.168648
other
Ba2La1Mg1Sb1O6
11
1
222.49
mp-1173259
8.120316
9.910588
1.783081
other
Sr4Nd2Ga2Cu4O14
26
1
356.28
mp-2230159
10.729578
10.43152
1.243383
other
Ba2Nd2Mg1Fe4O10
19
1
298.71
mp-1177896
13.147011
8.36327
-8.016297
other
Li6Mn3V3P12O42
66
1
809.52
mp-1046779
9.332669
10.15355
1.033183
other
Sr4Al2Ga2Co4O14
26
1
339.72
mp-1233756
11.796686
11.161646
-1.463684
other
Gd2Mg1Tl2W4O16
25
1
351.02
mp-1664776
11.218031
12.781558
0.556528
other
Li4Mn3Nb3Sb2O16
28
1
361.13
mp-1234855
11.471922
9.539049
-0.235076
other
Mg1Fe6Sb10I6O18
41
1
923.65
mp-1177066
14.166938
8.51484
-7.352621
other
Li12Mn2V6P12O48
80
1
953.29
mp-2230553
11.355578
10.286484
2.584089
other
La3Mg1Ti3Cr1O12
20
1
240.53
mp-756064
10.510234
12.103869
-1.744478
other
Li4Fe1Te1W2O12
20
1
216.51
mp-754975
9.987029
11.845514
-1.197392
other
Li4Cr2Ni3Te3O16
28
1
316.08
mp-766671
9.301835
3.956077
-8.523839
other
Li12Ni4P4C4O28
52
1
529.29
mp-1233257
10.523142
9.623667
1.994253
other
La4Mg1Ga2Fe2O12
21
1
310.12
mp-1176991
13.799561
7.255672
-6.509444
other
Li6Mn1Sb3P6O24
40
1
493.96
mp-686590
8.872907
3.540916
-6.917435
other
Sr16Cu8B1C7O40
72
1
939.32
mp-850257
13.416292
8.106034
-7.309532
other
Li6V4P8H4O32
54
1
575.39
mp-2715411
15.032993
3.760686
-7.566425
other
Na12Sc2Nb6Si12O48
80
1
1,071.52
mp-2714419
14.892522
3.704225
-7.912967
other
Na18Nb24Si33S3O144
222
1
3,188.22
mp-2715289
13.863343
4.811314
-7.132895
other
Na18Y6In6P18O72
120
1
1,683.25
mp-2715766
14.060347
3.403816
-8.213979
other
Na42Sc24Si21S15O144
246
1
3,307.66
mp-686635
13.734137
5.235826
-6.907994
other
Rb16Er7Ti9P24O96
152
1
2,201.73
mp-2712950
12.04849
3.985047
-8.333423
other
Ti6In6Si3S15O72
102
1
1,519.45
mp-2714493
12.790024
4.028009
-7.88039
other
Na21Mg12P9S9O72
123
1
1,534.61
mp-1228802
11.186518
11.228445
-2.41765
other
Ba2Li3Y3W8O32
48
1
655.99
mp-743603
13.071386
6.462811
-7.69457
other
Li3Ti3Fe1P6O24
37
1
468.73
mp-1233095
11.831281
11.28231
-1.525173
other
Er2Mg1Tl2W4O16
25
1
345.59
mp-2713837
11.938274
3.897666
-8.078262
other
Na18In24Si9S27O144
222
1
3,275.81
mp-1233548
1.308722
2.396371
-4.549518
other
Ca1Nb2Te4Cl10O1
18
1
585.18
mp-1173852
10.226835
11.3374
3.129542
other
Na8Ca12Ta8Ti12O60
100
1
1,181.05
mp-759506
14.076534
8.174449
-7.193254
other
Li4V2Cr2P8O28
44
1
531.33
mp-761121
14.072526
8.170625
-7.198028
other
Li6V3Cr3P12O42
66
1
797.82
mp-731625
7.683985
5.173172
-1.849017
other
Na6Zr6Fe2P12O48
74
1
1,057.02
mp-764622
11.693528
8.646897
-8.027803
other
Li3Mn3V3P12O42
63
1
789.73
mp-1224963
13.676735
5.906334
-6.457958
other
K8Sc8P8W4O48
76
1
1,179.78
mp-2714652
11.160468
3.92619
-7.670512
other
Na12Mg6Zn6S18O72
114
1
1,504.08
mp-2713510
14.212004
4.693302
-7.143495
other
Na30Y21Ta3P36O144
234
1
3,481.2
mp-1233587
1.318094
2.391081
-4.53416
other
Ca1Nb2Te4Cl10O1
18
1
600.4
mp-2714724
11.44303
3.810372
-7.727173
other
Na12Ca6Mg6S18O72
114
1
1,644.02
mp-1235468
-1.162548
0.959454
-3.992735
other
Li1Ta2Te4Br10O1
18
1
658.95
mp-1177322
11.601262
12.153969
0.071627
other
Li4Nb2Fe3Sb3O16
28
1
342.42
mp-1235075
11.245802
11.325337
-1.638173
other
Cs2Li1Tm2W4O16
25
1
343.45
mp-2219315
-9.912078
2.434233
-4.039059
other
Mg1Te6Mo2W2S2
13
1
397.51
mp-1076181
7.366818
11.466924
1.199221
other
Ba4Sr28Mn8Fe24O80
144
1
2,067.57
mp-2714209
14.63165
3.54761
-8.536345
other
Na6Ta24Si27S9O144
210
1
3,130.95
mp-691028
9.854564
10.285545
3.370325
other
Sr6La14Mg7Ti13O60
100
1
1,245.49
mp-695251
11.735299
4.936162
-3.622891
other
Ca4Al8Si8H36O50
106
1
1,102.98
mp-1234383
-4.698833
-6.226461
1.060486
other
Rb2Ba8Mg1Sb6O2
19
1
744.02
mp-2714309
13.851936
4.993638
-7.106318
other
Na21Mg9Ta3P18O72
123
1
1,548.27
mp-758142
12.8203
7.70616
-7.593871
other
Li6Ti1Fe3P6O24
40
1
469.33
mp-1234450
12.091363
10.90053
2.65288
other
Ba2Mg1Nb6N2O14
25
1
370.99
mp-779764
9.527354
13.977998
0.000839
other
Li10Ti2Mn3Co3O16
34
1
312.23
mp-2713195
14.565748
4.81488
-7.314103
other
Na15Hf3Sc9P18O72
117
1
1,586.39
mp-1247623
6.653955
12.22337
1.092806
other
Sr4Ca28Mn28Cr4O96
160
1
1,765.35
mp-1177947
9.017883
4.727362
-8.434935
other
Li8Fe4P4C4O28
48
1
546.25
mp-677016
13.442453
5.51998
-6.093043
other
Ca18Eu2P12S3O48
83
1
1,121.51
mp-755149
9.368894
12.396052
-1.823124
other
Li8Ti2Mn2W4O24
40
1
408.01
mp-774042
15.507745
5.810598
-2.218319
other
Li8Mn5Fe3B8O24
48
1
498.94
mp-1222859
9.54189
9.312426
2.248666
other
Li2La3Nd1Sb2O12
20
1
263.88
mp-2713568
10.968042
3.995037
-7.598392
other
Na30Zn24Si3S33O144
234
1
3,097.98
mp-778866
15.437779
5.700233
-2.265791
other
Li8Mn6Fe2B8O24
48
1
500.56
mp-677203
8.560359
1.077477
-4.399935
other
H48C16Se2N4O8
78
1
698.9
mp-2714043
12.698831
3.720592
-8.345113
other
Na6Sc24Si3S33O144
210
1
3,144.74
mp-2240862
11.322212
11.418691
-1.494269
other
Na6Mg1V2S2O6
17
1
289.91
mp-686602
10.126305
10.383014
3.2516
other
Ca4Pr8Ti8Zn4O36
60
1
737.37
mp-1236135
1.401896
2.475268
-4.513016
other
Li1Nb2Te4Cl10O1
18
1
572.82
mp-1375159
8.381928
11.374059
1.803491
other
Ca1La2Ti2Cr2O12
19
1
229.77
mp-684837
9.190252
11.694671
1.16285
other
Ca3La3V3Fe3O18
30
1
356.1
mp-1176375
8.220851
6.333989
-6.133519
other
Na6Ni4P4C4O28
46
1
602.11
mp-694963
10.343103
11.294035
0.644167
other
Sr7Sm1Fe4Mo4O24
40
1
515.32
mp-759256
14.321795
8.525682
-7.258588
other
Li6Mn1V3P6O24
40
1
470.8
mp-695298
13.721142
5.343356
-6.816562
other
K22Nb13In11P24O120
190
1
2,984.2
mp-2713210
14.88577
3.697285
-7.733305
other
Na15Nb9Si18Sn3O72
117
1
1,603.16
mp-1176410
8.520671
5.711986
-6.967409
other
Na8Ni4P4C4O28
48
1
609.26
mp-677195
2.90035
2.394395
1.821109
other
Nd20Si20Br2N34O18
94
1
1,359.86
mp-2715638
13.638342
4.728978
-7.314899
other
Na21In12Si3P15O72
123
1
1,650.1
mp-1099704
10.582339
10.129175
1.78463
other
La28Sm4Mn28Fe4O80
144
1
2,131.54
mp-1234250
11.915321
10.943496
0.379732
other
Ba2Ca1Al2Fe8O14
27
1
354.65
mp-2220990
11.765624
9.690097
2.162036
other
Sm4Mg1Ti2Mn2O12
21
1
273.47
mp-2714981
11.439089
3.848112
-7.782408
other
Na18Ca21Ge3S36O144
222
1
3,450.66
mp-1177171
14.601645
8.119081
-5.766742
other
Li5V3Bi2P6O24
40
1
512.35
mp-1177627
8.618913
3.925521
-7.258852
other
Li16Cr8C16S4O64
108
1
1,202.96
mp-1218723
6.702682
12.051895
1.497481
other
Sr6Ca2Nd2Mn10O30
50
1
578.9
mp-2715456
13.57859
4.88011
-7.251033
other
Na36Ta8Zn16P36O144
240
1
3,067.05
mp-768529
10.522093
8.812442
-7.320677
other
Li2Mn2V2P6O24
36
1
454.14
mp-19187
13.114915
6.521279
-7.046875
other
Na2Zr1Co1P4O14
22
1
278
mp-761239
8.718343
14.237186
-1.221931
other
Li4Mn3V2Fe3O16
28
1
288.75
mp-2713074
12.074773
4.203845
-8.314539
other
Ta3Al9Si3S15O72
102
1
1,351.43
mp-2714915
11.959764
3.846133
-8.063402
other
Na6Ca15Hf9S36O144
210
1
3,389.36
mp-758674
14.827863
8.524403
-5.506963
other
Li6V3P6W1O24
40
1
479.34
mp-1173875
7.345808
12.011271
1.942406
other
Na2Ca4La14Mn20O60
100
1
1,196.3
mp-698018
12.917579
5.91109
-1.317399
other
Li2Al2Si4H4O14
26
1
306.16
mp-2218000
12.015685
10.703093
0.369014
other
Mg1Mo1Os1Pb2O6
11
1
185.31
mp-1120805
8.120371
0.718526
-4.4024
other
H24Pb2C4I12N4
46
1
990.17
mp-1076296
6.777897
10.104062
0.021773
other
Ba24Sr8Co4Cu28O80
144
1
2,112.78