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-1223305
10.339515
4.306426
-5.517964
other
K1Zn1H5S2O10
19
1
214.87
mp-2232180
9.780169
8.157437
-6.617777
other
Mg1Co2P2O8F2
15
1
182.31
mp-1233774
9.833648
10.248167
-2.843861
other
Rb4Mg1U4Cr4O24
37
1
621.16
mp-757923
7.970707
13.519693
-1.072267
other
Li4Nb2Fe3Cu3O16
28
1
301.4
mp-753012
9.975483
11.149168
-3.232337
other
Li1V1Te1W2O12
17
1
205.61
mp-1173226
8.559922
10.933331
2.398257
other
Sr6La2Ta4Co4O24
40
1
520.47
mp-774389
14.034719
8.441098
-7.472251
other
Li4Mn1V3P8O28
44
1
540.42
mp-2715466
13.679332
5.077323
-7.265297
other
Na12Al4In4P12O48
80
1
990.09
mp-695250
9.966558
9.575754
3.29233
other
Ba1La7Mg5Nb3O24
40
1
527.39
mp-695536
10.054073
3.808311
-5.333068
other
La2H12S6N6O18
44
1
513.44
mp-690554
7.036697
10.922676
1.385123
other
Sr5La5Cu1Ni4O20
35
1
469.1
mp-1215828
13.339885
4.731587
-2.699325
other
Zn8B4H3O15F1
31
1
398.26
mp-683616
13.613452
5.937325
-7.559452
other
Li5Ti7In1P12O48
73
1
917.76
mp-887341
14.173573
8.513862
-7.34981
other
Li12Mn2V6P12O48
80
1
954.53
mp-1177049
9.993345
8.188851
-6.544687
other
Li6Co3Ni1P6O24
40
1
453.88
mp-1076678
6.3148
11.072608
0.132189
other
Sr24Ca8Co20Cu12O80
144
1
1,885.77
mp-1076802
5.449781
11.292062
-0.610698
other
Sr3Ca5Fe5Co3O24
40
1
455.01
mp-1076450
7.419956
11.765393
1.317115
other
Sr12Ca20Mn16Fe16O80
144
1
1,920.83
mp-756577
9.918832
12.162851
-1.71279
other
Li8Mn2Nb2W4O24
40
1
429.18
mp-2229378
13.398278
7.540841
-6.124846
other
Mg1Zn2Co2P2O10
17
1
201.76
mp-2220046
12.495087
10.86606
-0.292214
other
Y1Mg1Co1W2O8
13
1
161.4
mp-768545
11.751515
8.703021
-8.148757
other
Li4Mn2V2P6O24
38
1
460.14
mp-2716345
14.271775
4.896257
-7.4248
other
Na18Y15Ta9P36O144
222
1
3,309.2
mp-2713021
12.818228
3.686511
-8.509222
other
Y6Hf6Si3S15O72
102
1
1,693.25
mp-2715202
11.482351
3.80031
-7.755307
other
Na9Ca11Ta1S18O72
111
1
1,778.89
mp-759095
12.591381
6.38534
-6.643499
other
Li1Sn2P4H3O16
26
1
298.23
mp-1235065
11.266282
11.811204
-2.560344
other
Rb3Li1Tb1V2O8
15
1
262.43
mp-1371750
7.606441
5.32284
-2.433933
other
Ca4Al2H22C1O20
49
1
445.15
mp-1046610
10.338378
10.782331
1.025371
other
Ba2Tl2Zn2Cr3O10
19
1
294.37
mp-2233446
12.370743
11.566892
-1.090981
other
Mg1Al1Cu1W2O8
13
1
142.08
mp-2713565
13.841683
5.272995
-7.413891
other
Na12Ca3Ti9P18O72
114
1
1,518.92
mp-2714243
13.601544
4.933194
-7.251247
other
Na21Ca3Ga9P18O72
123
1
1,530.05
mp-2231347
11.544054
11.062554
-1.085638
other
Na8Mg1Mo2N4O4
19
1
296.87
mp-2231680
10.431643
10.446192
-0.380612
other
La2Mg1Fe2Te2O12
19
1
248.96
mp-686718
12.937737
6.124385
-0.555991
other
Sr5Al11Tl1Si13O48
78
1
1,913.18
mp-766788
9.602176
3.723681
-8.388041
other
Li12Fe4P4C4O28
52
1
549.53
mp-776348
8.957129
3.801324
-7.164299
other
Na8Bi4C8S2O32
54
1
783.35
mp-1178090
11.624141
7.943887
-8.121291
other
Li12Mn7V1P12O48
80
1
927.7
mp-1218109
5.771959
11.237647
0.15116
other
Sr1Pr1Fe1Co1O6
10
1
115.36
mp-2713429
15.009141
3.739654
-7.690165
other
Na30Nb21Al3Si36O144
234
1
3,184
mp-1235477
11.381026
11.257551
-1.58248
other
Rb2Li1Nd2W4O16
25
1
357.6
mp-2714033
13.631672
5.054237
-7.22034
other
Na21Mg3Ga9P18O72
123
1
1,469.32
mp-1099913
12.533773
10.589486
1.631914
other
K20Na12Nb24W8O80
144
1
2,133.69
mp-1006611
7.586576
4.248951
-3.495345
other
Sb12S9N18O36F36
111
1
2,059.81
mp-2714154
13.491895
5.241915
-7.228072
other
Na42Mg15Ge9P36O144
246
1
2,938.59
mp-1076118
6.288692
11.228334
0.15737
other
Sr24Ca8Co28Cu4O80
144
1
1,908.8
mp-1235589
10.663914
9.360243
-1.037742
other
Li1Sb3Te1Cl1O6
12
1
334.95
mp-2712866
13.6092
3.453597
-8.627208
other
Na18Ti24Si21S15O144
222
1
3,001.96
mp-1257731
11.737915
5.443506
-2.666559
other
Na4Al4Si6H8O24
46
1
589.34
mp-677269
10.991163
9.969236
3.683572
other
Ca16Zr9Ta7N7O41
80
1
1,046.22
mp-768561
13.426513
8.399102
-7.950458
other
Li6Mn2V2P6O24
40
1
486.09
mp-774642
8.799918
4.876559
-8.132407
other
Na8Mn4P4C4O28
48
1
626.44
mp-1252241
7.906893
10.846254
1.114727
other
Sr2Al1Tl1Co2O7
13
1
176.45
mp-2713849
14.862331
3.646782
-7.89661
other
Na18Zr12Si15S3O72
120
1
1,705.11
mp-1233546
14.354389
8.226046
-5.462457
other
Mg1Cu1P4Ru2O14
22
1
271.95
mp-1233184
11.389303
9.371165
2.492301
other
K2Ca1Nd4Nb2O12
21
1
330.77
mp-759529
11.812803
8.49362
-7.903702
other
Li4V4Fe4P16O56
84
1
1,052.31
mp-757753
12.624027
8.087271
-7.820966
other
Li6V1Fe3P6O24
40
1
468.42
mp-775072
8.980742
13.608754
-0.974123
other
Li4Mn3Cu2Sb3O16
28
1
321.45
mp-780485
12.28758
8.221794
-7.548262
other
Li4V4P8H4O32
52
1
560.2
mp-532617
13.618208
5.502387
-6.964853
other
Rb16Yb3Ti13P24O96
152
1
2,098.26
mp-2713022
12.583178
3.663227
-8.68699
other
Na18Si21Ge24S15O144
222
1
2,779.88
mp-776411
9.85661
8.270895
-6.763088
other
Li8Co8P8O32F8
64
1
738.69
mp-2716307
13.439827
5.16928
-7.730721
other
Na9Sc3Ge9P18O72
111
1
1,390.06
mp-2714892
11.049324
4.21128
-7.771181
other
Na6Zn15Sn9S36O144
210
1
2,985.52
mp-1220239
-4.471029
-2.810421
-3.72083
other
Rb3Ag1Ge4Se10O2
20
1
662.41
mp-775798
13.984109
8.105183
-7.630597
other
Li4Mn5V1P6O24
40
1
483.86
mp-2713041
12.788294
3.79377
-8.515819
other
Sc9Ta3Si3S15O72
102
1
1,560.94
mp-1045777
8.746624
1.511825
1.049257
other
Ba4Zn2Cu2Sn4F28
40
1
626.99
mp-2716344
14.282965
5.026294
-7.543116
other
Na9Zr9Ga3P18O72
111
1
1,568.68
mp-1306433
7.781565
10.401179
1.406024
other
Ba4Y2Tl2Co4O14
26
1
396.37
mp-2715301
13.845497
5.001125
-7.188712
other
Na54Mg24Nb12P54O216
360
1
4,629.31
mp-1227769
9.125286
11.393587
2.285352
other
Ca6La2Ti4Cr4O24
40
1
462.53
mp-779783
15.585157
6.227402
-2.083203
other
Li8Mn2Fe6B8O24
48
1
493.21
mp-1177586
13.286453
8.372616
-8.079604
other
Li12Mn4V4P12O48
80
1
943.77
mp-1235570
10.468431
9.447478
2.434309
other
Li1Tb4Al2Fe2O12
21
1
233.65
mp-1234499
9.109466
7.380631
-1.964713
other
Mg1Tl2Pb16Br18O8
45
1
1,386.11
mp-1225838
12.688161
6.141783
-0.537107
other
K8Gd3Si12Cl1O34
58
1
930.11
mp-1234152
11.400462
9.504775
-0.342364
other
Mg1Fe6Sb10I6O18
41
1
939.22
mp-1099799
7.953043
11.895832
1.96885
other
Sr16Ca16Ti4Mn28O80
144
1
1,947.77
mp-2714292
13.937774
4.757835
-6.925951
other
Na21Y9Zn3P18O72
123
1
1,725.99
mp-769490
8.183727
6.317525
-6.314261
other
Na6Ni4P4C4O28
46
1
557.28
mp-1176831
15.536173
6.346897
-2.086771
other
Li8Mn1Fe7B8O24
48
1
499.38
mp-1076134
9.507846
11.196033
2.259636
other
Sr12Ca20Ti12Mn20O80
144
1
1,944.05
mp-1667275
10.638253
9.803273
1.340281
other
Ca2La2Cr2Sb2O12
20
1
264.67
mp-1247604
7.928854
11.965677
1.501013
other
Sr1Ca7Mn6Cr2O20
36
1
472.59
mp-2714162
13.535136
5.017404
-7.210298
other
Na21Zn3Ga9P18O72
123
1
1,470.41
mp-2715356
13.858299
4.990292
-7.218255
other
Na36Mg16Ta8P36O144
240
1
3,045.9
mp-690607
6.388964
5.052998
-4.377775
other
K2Ba1Ni1N6O12
22
1
350.43
mp-1225986
8.886619
7.092633
-3.598083
other
Cu2Ag5Se4N1O15
27
1
386.68
mp-2714949
10.993898
4.075358
-7.634649
other
Na9Zn9In3S18O72
111
1
1,528.02
mp-1176649
11.525316
7.977248
-8.186275
other
Li8Mn8P8O32F8
64
1
756.35
mp-1177601
13.230031
8.375548
-8.059975
other
Li12Mn4V4P12O48
80
1
935.19
mp-778158
15.584682
6.078411
-2.112509
other
Li8Mn3Fe5B8O24
48
1
495.95
mp-2714591
14.010015
3.969605
-7.797326
other
Na21Si15Sn12P3O72
123
1
1,625.26
mp-1177778
13.384896
8.288012
-7.67312
other
Li6V3Fe3P12O42
66
1
805.51
mp-777583
15.578294
6.061893
-2.11129
other
Li8Mn3Fe5B8O24
48
1
505.07
mp-1220770
5.270791
3.02588
-3.926489
other
Ni2C15Se4S16N1
38
1
913.01
mp-1235291
8.528323
7.114565
-3.433243
other
Li1Au4Se4Cl4O12
25
1
518.03
mp-1235640
13.439816
8.570612
-1.243538
other
Li1V2Zn2Si2O10
17
1
188.34