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-1210900
8.709837
7.665708
-3.7413
other
Na2Ti3Mn1Si4O22
32
1
447.4
mp-778203
15.531979
6.359358
-2.091088
other
Li8Mn1Fe7B8O24
48
1
498.85
mp-2716544
13.76783
4.938065
-7.456038
other
Na15Zr3Ga9P18O72
117
1
1,480.98
mp-1215670
-5.282036
-2.65671
-4.450971
other
Zn1Cu2Sn1Se3S1
8
1
184.04
mp-2712893
12.617862
3.649389
-8.411801
other
Y9Ta3Si3S15O72
102
1
1,739.41
mp-2713532
14.018383
4.777922
-7.272854
other
Na15Y9Ge3P18O72
117
1
1,663.28
mp-1236186
14.317394
7.179517
-5.57725
other
Ba2Li1Mn2P4O14
23
1
322.78
mp-1233233
8.526758
3.989792
-6.489097
other
Ca1Tl6C2O6F2
17
1
356.45
mp-1247586
7.618936
12.06892
1.482719
other
Sr1Ca7Mn6Cr2O21
37
1
470.62
mp-1099902
10.895915
10.278719
1.392966
other
La28Sm4Mn4Fe28O80
144
1
2,070.74
mp-769469
8.456464
5.687813
-7.308436
other
Na4Mn4P4C4O28
44
1
595.72
mp-1233448
11.690704
11.166119
-1.360809
other
Rb2Nd2Mg1W4O16
25
1
362.78
mp-2716290
14.061443
4.857743
-7.38259
other
Na30Zr15Zn9P36O144
234
1
3,204.51
mp-1234249
9.117711
7.382027
-1.970093
other
Mg1Tl2Pb16Br18O8
45
1
1,384.76
mp-2713038
12.94523
3.937763
-8.515835
other
Ca3Hf9P6S12O72
102
1
1,615.8
mp-766568
10.831924
8.007416
-7.3712
other
Li4Co3Ni3P6O24
40
1
445.32
mp-2713183
13.071097
4.720425
-8.253107
other
Hf6Ge6P12S6O72
102
1
1,424.91
mp-686382
10.135494
8.966578
2.155953
other
Sr2La14Mg2Ga14O45
77
1
980.33
mp-1235353
-1.123902
0.974684
-4.01843
other
Li1Ta2Te4Br10O1
18
1
693.01
mp-768560
13.44174
8.396973
-7.959054
other
Li6Mn2V2P6O24
40
1
485.8
mp-2712879
14.359182
3.733234
-7.656622
other
Na21Nb3Si18Sn9O72
123
1
1,615.6
mp-2714706
13.860137
5.524665
-7.515376
other
Na18Ti21Zn3P36O144
222
1
2,898.05
mp-1046109
11.762443
9.915918
2.126513
other
Ba2Ca2Ti3Tl2O10
19
1
304.42
mp-2713168
15.093221
3.669256
-7.838548
other
Na15Ta9Si18Sn3O72
117
1
1,586.86
mp-2240370
9.374577
2.414037
1.668014
other
Na3Mg1Mo1O3F3
11
1
149.32
mp-753933
10.068099
11.223403
-1.30458
other
Li4Sb1Te2W1O12
20
1
230.85
mp-1177321
11.09454
13.248883
-0.896154
other
Li4Nb2V3Ni3O16
28
1
300.62
mp-1233782
1.376132
2.434433
-4.563231
other
Mg1Nb2Te4Cl10O1
18
1
576.46
mp-1223744
11.361708
7.308547
-4.350117
other
K2Mg5Cu3As6O24
40
1
503.68
mp-1664329
10.859441
7.637409
-7.095071
other
Li2Mn2P4H3O16
27
1
285.9
mp-2228426
7.633136
11.576781
1.189912
other
Ba2Mg1Mn3Tl2O10
18
1
268.25
mp-769474
8.821857
4.848746
-8.144499
other
Na8Mn4P4C4O28
48
1
620.69
mp-778083
15.534917
6.385406
-2.09366
other
Li8Mn1Fe7B8O24
48
1
490.79
mp-1228814
12.280658
6.999674
-1.319211
other
Ca8Sc1Fe7Si20O60
96
1
1,164.18
mp-2714793
13.887764
5.558201
-7.50515
other
Na9Ti9Al3P18O72
111
1
1,410.85
mp-1235940
12.036073
11.203634
-1.705828
other
Li1Lu2W2Cl2O8
15
1
253.41
mp-39123
14.943825
3.971522
-7.65791
other
Na6Zr4Si4P2O24
40
1
554.81
mp-768089
8.511357
5.699415
-6.961987
other
Na8Ni4P4C4O28
48
1
609.58
mp-766693
9.310616
3.955795
-8.528185
other
Li12Ni4P4C4O28
52
1
528.16
mp-2219877
12.519462
10.82096
-0.451837
other
Y1Mg1Co1W2O8
13
1
171.92
mp-1234265
10.036969
3.677482
-4.871576
other
Mg1Cu4H8C2O10
25
1
264.93
mp-766014
11.921064
7.71885
-7.776617
other
Li6Cr1Fe3P6O24
40
1
464.6
mp-2228702
9.830287
10.415606
1.335757
other
Sr4Mg1Fe2Cl2O6
15
1
266.14
mp-697313
12.914768
6.149678
-0.495605
other
Al24Tl10Cd7Si24O96
161
1
4,004.52
mp-2716138
13.237865
3.604633
-8.348908
other
Na18Al12Si9S9O72
120
1
1,422.12
mp-2715105
10.956355
4.084325
-7.576762
other
Na9Nb1Zn11S18O72
111
1
1,505.77
mp-1173765
12.415807
6.711421
-7.471879
other
Na8Ti4Fe4P12O48
76
1
966.43
mp-1234246
13.721759
7.914442
-0.811594
other
Sr2Mg1V2Si4O14
23
1
298.23
mp-695112
14.970723
3.942739
-7.685135
other
Na12Zr8Si8P4O48
80
1
1,140.06
mp-760349
14.271017
8.456338
-7.368391
other
Li12Mn2V6P12O48
80
1
933.53
mp-2227531
11.317281
9.636213
1.411579
other
Ba2Sm1Mg1Mo1O6
11
1
180.85
mp-703276
12.767403
6.223274
-0.613609
other
Ca5Al11Tl1Si13O48
78
1
1,915.93
mp-2714278
13.97896
4.778372
-6.905724
other
Na21Y9Mg3P18O72
123
1
1,716.53
mp-2217279
11.581717
9.72433
1.31826
other
La2Mg1Zn1Mo1O6
11
1
168.47
mp-2715336
13.81876
5.028945
-7.160616
other
Na36Mg16Nb8P36O144
240
1
3,049.75
mp-761819
9.02051
12.523644
-1.786019
other
Li4V1Fe1Te2O12
20
1
205.53
mp-1120751
12.655183
6.560278
-0.948651
other
Ba6Zn1Co5Si6O24
42
1
652.26
mp-1173398
10.404831
4.094479
-5.342431
other
Sc2H14S4N2O21
43
1
460.63
mp-1223539
10.647675
7.347651
-1.567343
other
K1Mg3Al1Si3O12
20
1
256.65
mp-2713019
12.381397
3.759746
-8.419481
other
Y6Ti6Si3S15O72
102
1
1,603.96
mp-2219044
12.826747
10.602886
0.060542
other
Y1Mg1Mo1W2O8
13
1
180.93
mp-1235510
1.406506
2.490588
-4.490602
other
Li1Nb2Te4Cl10O1
18
1
565.59
mp-1105132
7.234927
2.424423
-2.945589
other
B1H2S3N3F4
13
1
428.79
mp-1264155
11.935349
6.628915
-0.829612
other
Ca12Al12Si6H4O48
82
1
1,069.78
mp-850892
12.636357
8.267168
-8.187444
other
Li12Mn5V3P12O48
80
1
928.74
mp-850229
11.057191
8.579995
-7.339905
other
Li2V4P8H4O32
50
1
547.49
mp-1223577
9.762989
5.543696
-4.457942
other
K1Mg1H5Se2O10
19
1
239.99
mp-1046524
9.739789
10.80696
0.736784
other
Ba2Tl2Zn2Fe3O10
19
1
283.53
mp-1099665
6.530712
11.448578
0.419722
other
Sr16Ca16Fe8Co24O80
144
1
1,894.93
mp-2716528
14.216643
4.888821
-7.355489
other
Na30Mg9Zr15P36O144
234
1
3,213.24
mp-1223536
-4.655471
-2.996047
-3.818268
other
K1Ba3Ga5Se10Cl2
21
1
612.14
mp-1233796
9.115899
7.356959
-1.989464
other
Mg1Tl2Pb16Br18O8
45
1
1,403.68
mp-2714124
11.849597
4.153324
-8.184067
other
Na3Ga12P3S15O72
105
1
1,369.79
mp-1235808
10.219842
10.116149
-0.93552
other
Rb2Li1Nb2Te2O12
19
1
313.52
mp-1045910
9.378707
0.610627
0.579752
other
Ba4Mg2Mn4Cu2F28
40
1
551.28
mp-1223774
13.939217
5.6978
-6.61033
other
K7Rb1Ti8P8O40
64
1
902.2
mp-778830
9.68991
13.380785
-0.074571
other
Li10Ti2Fe3Co3O16
34
1
307.62
mp-776686
11.762424
7.676729
-7.77739
other
Li5Fe3Ni2P6O24
40
1
451.39
mp-732284
11.915108
7.676762
-4.546942
other
Li4Ti8Co2As8O40
62
1
770.3
mp-762415
9.732347
13.679107
-0.207688
other
Li4Mn3Nb3Fe2O16
28
1
327.58
mp-1232994
11.488955
10.036927
2.284103
other
Li1Sm4Ti2Mn2O12
21
1
259.83
mp-780675
13.258762
8.404759
-8.100941
other
Li12Mn4V4P12O48
80
1
907.79
mp-1228520
11.992093
7.59982
-6.628279
other
Ba3V2Ni6P4O24
39
1
498.23
mp-1235165
8.758204
2.450067
-1.294891
other
Li1Te4H4O6F8
23
1
339.67
mp-2716540
14.219548
4.845449
-7.443481
other
Na30Hf15Zn9P36O144
234
1
3,158.9
mp-2241389
9.248236
9.40967
2.083389
other
La2Mg1Zn1Ni1O6
11
1
145.21
mp-2715079
11.499363
3.919732
-7.906407
other
Na9Mg9Ga3S18O72
111
1
1,447.64
mp-2223675
-7.364114
3.087383
-5.32529
other
Mg1Te2Mo2W1S4
10
1
284.98
mp-1177332
15.578519
6.222153
-2.086517
other
Li4Mn1Fe3B4O12
24
1
245.38
mp-1233130
13.629209
8.327765
-7.288781
other
Mg1V1Fe1P4O14
21
1
282.82
mp-2713497
12.94735
4.781674
-8.14001
other
Zr6Ge6P12S6O72
102
1
1,446.34
mp-1233629
8.366129
7.191381
-3.505378
other
Mg1Au4Se4Cl4O12
25
1
526.38
mp-720079
10.567378
11.279904
2.447244
other
Ba2Na7Ti16Bi7O48
80
1
992.94
mp-766037
12.277825
7.092057
-1.524851
other
Li8Sc2Fe6Si16O48
80
1
877.42
mp-1219635
-4.663113
-2.988367
-3.805229
other
Rb1Ba3Ga5Se10Cl2
21
1
620.21
mp-1273218
8.067728
10.903224
1.526847
other
Sr2La2Mn2Ru2O12
20
1
260.2
mp-2713452
12.472803
3.890067
-8.657691
other
Zr6Si6Ge6S12O72
102
1
1,492.89
mp-1224171
8.97756
8.495803
-1.664656
other
Hg11I2Br1Cl1O4
19
1
509.88
mp-1235259
10.471606
9.423279
2.445867
other
Li1Tb4Al2Fe2O12
21
1
231.9
mp-1233634
13.507601
8.305205
-7.42789
other
Mg1V1Fe1P4O14
21
1
269.62