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-541878
-3.441039
-1.377125
-5.521869
other
K8Ge8S20
36
15
1,002.56
mp-758879
7.633897
6.14939
-3.514379
other
Fe2O4F2
8
15
93.09
mp-3922
-3.609064
-1.376569
-5.398426
other
Ag4Sb4S8
16
15
387.34
mp-754665
6.867691
6.093532
-3.1927
other
Pb2Br4O12
18
15
298.65
mp-768615
1.065576
1.655373
-5.21745
other
Sr6La4Cl24
34
15
1,045.65
mp-685608
8.863111
1.94744
1.879727
other
K4U2F12
18
15
305.67
mp-769390
10.502746
10.908317
3.284561
other
Ca6Ta4O16
26
15
376.06
mp-979418
-4.722007
0.984786
3.363445
other
Sm4Re6B12
22
15
270.23
mp-683910
-2.600872
-0.452791
-5.436219
other
Ag28P12S44
84
15
1,830.85
mp-1190542
-7.944558
-1.735915
2.878018
other
Tb2Si6Ni16
24
15
294.23
mp-28779
11.484157
9.274534
1.144036
other
U2Sb2O10
14
15
201.07
mp-1210513
2.571539
2.778012
-3.728124
other
Ni2I12N12
26
15
663.35
mp-768361
-4.838418
-0.910392
-5.310214
other
Li8Fe8S12
28
15
506.64
mp-753621
-5.241019
-4.010558
-2.662292
other
Li10Sb2S2
14
15
251.39
mp-1222550
8.847607
13.426626
-1.039417
other
Mg4Fe14O24
42
15
468.17
mp-759850
15.289017
12.446051
-1.06601
other
V4O4F6
14
15
165.26
mp-1211181
7.195652
6.219144
-4.321023
other
Na4P4O26
34
15
528.31
mp-1182246
8.814366
8.058667
-2.463193
other
Ba2Ge6O16
24
15
301.33
mp-1188815
-2.932548
-2.45824
-4.292371
other
U4Co2S10
16
15
294.61
mp-850283
12.021173
10.887094
2.712849
other
Hf2Nb2O8
12
15
137.42
mp-4426
9.393458
6.485741
-2.887918
other
Li8Se2O10
20
15
190.71
mp-26214
9.259089
8.003485
-5.550125
other
Fe4P8O28
40
15
516.21
mp-1212217
6.830149
6.075777
-3.936548
other
Mg4As4O44
52
15
730.05
mp-1045679
10.316308
10.519243
-1.019998
other
Nb4Te2O16
22
15
325.99
mp-1246121
1.939107
1.940351
1.260082
other
Ca6In4N8
18
15
289.93
mp-32527
12.666696
8.287313
-7.358755
other
V2P8O24
34
15
447.58
mp-1080432
7.961125
5.232874
-4.283842
other
K4Se4O2
10
15
253.44
mp-1003735
8.844539
14.773179
-0.409916
other
Mg4Mn8O16
28
15
311.97
mp-29894
11.305432
10.881438
-2.680325
other
Hg4W2O8
14
15
229.92
mp-18575
10.827382
11.705251
2.351444
other
Nb4Zn6O16
26
15
305.36
mp-28871
-1.168494
2.750517
-3.101382
other
In12Sn4I20
36
15
1,447.8
mp-772864
11.427409
7.398794
-0.692582
other
Rb8Ge8O20
36
15
739.08
mp-752677
-0.126336
0.815939
-3.714605
other
Ba4Y2Br14
20
15
673.8
mp-1392416
9.433779
0.61481
0.578755
other
Ca2Fe2F10
14
15
202.62
mp-1104701
8.50008
6.482436
-5.931803
other
Mn2S2O10
14
15
176.7
mp-1289249
13.695248
7.6357
-0.983265
other
Mn4Si4O12
20
15
230.97
mp-1246432
2.381816
2.270786
1.604003
other
Ga4Ge6N8
18
15
255.47
mp-1186251
-7.85138
-2.730418
5.271912
other
Nd4Co6Ge10
20
15
341.25
mp-3496
5.460573
3.625892
-4.105433
other
S6N4O4
14
15
300.22
mp-754521
7.605199
6.558196
-2.903262
other
Sr2I4O12
18
15
302.07
mp-1209080
1.573279
2.581882
-4.778325
other
Rb2Ta2Cl12
16
15
454.95
mp-29177
8.425651
1.83519
-0.52397
other
Ba2Te4F20
26
15
394.17
mp-542387
-5.314663
-6.164135
0.710135
other
Na24Tl4Sb16
44
15
1,322.53
mp-29375
-3.658113
-1.687554
-5.606377
other
Na12In4S12
28
15
698.88
mp-1246363
2.163793
2.322122
1.294746
other
Ga4Bi8N12
24
15
449.19
mp-540658
8.508316
12.679646
-1.072368
other
Na6Fe10O18
34
15
422.67
mp-1143109
10.890082
8.056125
-3.520619
other
Si8Mo4O28
40
15
583.81
mp-17714
13.744336
4.408025
-1.713945
other
Ho8B12O30
50
15
483.49
mp-12263
8.75196
1.378563
-0.407382
other
Li4Au4F16
24
15
302.63
mp-17245
8.801601
1.32891
1.095858
other
Na6Ta2F16
24
15
288.58
mp-1389691
9.29035
0.701095
-0.2309
other
Ca2Ni2F10
14
15
195.99
mp-14128
8.578932
1.293512
1.448371
other
K4Hf2F12
18
15
252.52
mp-676103
6.812963
5.758797
-3.274232
other
Rb2Cl2O8
12
15
140.67
mp-1211264
1.625221
2.912368
-4.778979
other
K2W2Cl12
16
15
429.3
mp-1247149
1.77639
1.808565
1.508205
other
Sr10Zr4N12
26
15
541.46
mp-1104369
12.739894
13.29161
-0.964088
other
Na2V4O8
14
15
176.07
mp-1247395
3.00673
2.344189
0.420872
other
Ca10C4N12
26
15
329.15
mp-22737
-3.455369
-1.456693
-5.286606
other
Sb16Pb6S30
52
15
1,409.08
mp-761184
9.989888
9.448508
0.325069
other
Na8Sn4O12
24
15
287.45
mp-766396
13.290421
6.6868
-7.031171
other
Ti2P8O24
34
15
445.69
mp-38407
-4.849801
-5.320552
0.482384
other
Li10Si2As6
18
15
325.67
mp-753130
9.696034
0.480488
0.119081
other
Li8Cu2F14
24
15
286.71
mp-770799
10.035014
11.972604
0.790539
other
Li10Nb2O10
22
15
237.83
mp-1379381
12.355967
7.842271
-2.722165
other
Si8W4O28
40
15
596.22
mp-1216303
10.14906
9.196776
-6.35964
other
V2P2O10
14
15
169.18
mp-19913
-3.160967
-4.495627
0.864671
other
Ba6In4P8
18
15
552.35
mp-1188510
8.176669
1.620826
0.575129
other
Cs2Sb4F14
20
15
458.34
mp-772627
11.355959
11.228368
-2.576831
other
Ho4W6O24
34
15
477.28
mp-989631
0.834112
2.588936
1.774848
other
La4Mo4N12
20
15
326.46
mp-1245644
0.595047
2.548383
1.750688
other
Ga4Co8N12
24
15
262.7
mp-1103845
8.191059
6.648203
-5.545033
other
Co2S2O10
14
15
174.25
mp-674503
8.178102
1.997464
-0.200329
other
Hg4Sb2F12
18
15
350.08
mp-1211791
7.610823
7.218458
-4.420019
other
Lu4S6O40
50
15
775.29
mp-1247122
0.96554
2.158896
1.64355
other
Ba6Mn4N8
18
15
316.63
mp-626241
10.466044
3.710519
-4.090638
other
Sr2H32O20
54
15
458.59
mp-580999
1.841243
2.513047
-4.989523
other
Ga4Ni2Cl16
22
15
589.01
mp-1101098
-5.755981
-2.316453
-1.415835
other
Ti8Cr2Te16
26
15
661.27
mp-754405
11.555231
9.363413
2.474548
other
Ce4Ti2O10
16
15
228.92
mp-18607
10.557623
9.527081
-2.039049
other
Mn4Te6O16
26
15
405.51
mp-977298
3.448322
-0.642429
-2.254663
other
Li4Be4H12
20
15
154.36
mp-1245422
0.542011
2.433964
1.83701
other
Mn8Ru4N12
24
15
243.85
mp-3978
12.663281
6.316223
-0.234653
other
Sr6Si6O18
30
15
447.86
mp-1046509
8.805028
12.794538
-1.994007
other
Mn10Te6O36
52
15
647.11
mp-28136
8.813784
8.283818
-1.727291
other
Hg8I4O4
16
15
422.21
mp-1246041
2.298601
2.122477
1.748251
other
Mg6Ga4N8
18
15
204.13
mp-831182
10.068962
10.226419
0.100121
other
Na14Cr4O12
30
15
451.36
mp-18108
13.711352
4.434016
-1.82736
other
Dy8B12O30
50
15
488.09
mp-642227
-3.407702
-1.550955
-5.323244
other
Sb16Pb10S34
60
15
1,616.12
mp-755199
13.758823
9.344754
-1.08039
other
V4Ge4O12
20
15
239.23
mp-1190160
8.92658
6.796201
-3.632695
other
K4Se4O14
22
15
361.71
mp-761686
6.408916
8.90939
-0.497694
other
Na8Bi4O12
24
15
329.13
mp-675299
12.367058
6.395629
0.021667
other
Ca8Si4O16
28
15
375.7
mp-4907
-3.512307
-1.640832
-5.571473
other
Na12Sn4S14
30
15
737.5
mp-1246828
2.259922
1.811889
1.787157
other
Y8Sc4N12
24
15
377.64
mp-769213
8.98138
6.851048
-3.968809
other
Dy4Se6O24
34
15
428.5
mp-1201377
6.263545
4.99855
-4.682518
other
Pr8N24O72
104
15
1,418.49
mp-1029801
0.823035
2.516873
1.67158
other
Cs4Mn8N12
24
15
519.79
mp-1245624
0.857069
2.194564
1.730423
other
Ca6Os4N8
18
15
256.43
mp-541895
-3.140046
0.88406
-3.901922
other
Na8Re12S24
44
15
888.56
mp-757078
11.183709
12.48268
-3.767884
other
V4Fe2O12
18
15
239.27