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-757440
8.687948
6.144611
-6.016673
other
Cr3S6O24
33
146
451.84
mp-14853
9.612471
8.435613
3.236702
other
Ba3Er4O9
16
146
265.72
mp-545387
8.337886
4.148247
-6.640424
other
K4C1O4
9
146
157.75
mp-777888
10.387641
1.821644
2.188865
original
Li4Fe4F12
20
146
228.61
mp-704240
9.3889
7.888085
-6.065045
other
Co6P6O24
36
146
498.27
mp-777584
9.839179
9.406803
0.573557
other
Na7Nb1O6
14
146
190.44
mp-1220013
-5.43699
-1.074247
-3.897123
other
Ni4As3S5
12
146
183.26
mp-1229330
10.235739
10.951372
-3.157209
other
Bi1W18O60
79
146
2,016.48
mp-1218873
-2.772717
-2.560758
-5.86411
other
Sm18Al10S42
70
146
1,533.39
mp-570512
1.737641
2.860261
-4.716399
other
Li4W4Cl24
32
146
792.03
mp-562815
8.314479
4.475248
-6.282528
other
Cs4C1O4
9
146
244.58
mp-552623
8.996541
4.002192
-7.276071
other
Na4C1O4
9
146
107.21
mp-1199011
11.010858
11.8723
2.643222
other
Nb8Ag4O22
34
146
433.92
mp-772988
9.210068
5.528058
-6.607967
other
V3S6O24
33
146
420.38
mp-2226935
-5.182697
-0.894229
-4.220304
other
Mg1Co4S8
13
146
195.13
mp-768907
9.671731
9.148692
0.362678
other
Sr3Te1O6
10
146
155.94
mp-1225042
-6.934875
-3.496553
0.1923
other
Ga3Te9Pd32
44
146
744.01
mp-1229161
12.232662
6.89327
-5.813955
other
Ag6P6O19
31
146
434.22
mp-504921
-0.180403
0.420259
-3.414144
other
Sc7C1Br12
20
146
507.65
mp-14322
9.534445
8.431382
3.273524
other
Ba3Tm4O9
16
146
268.81
mp-685318
9.683659
8.597754
-0.702988
other
Bi60As4O100
164
146
2,809.37
mp-23045
4.320865
2.955545
-4.042215
other
B3N3Cl6
12
146
268.55
mp-675672
10.723735
9.614448
3.836166
other
Zr10Sc4O26
40
146
475.7
mp-1224836
-8.037733
-2.392141
3.516522
other
Ga1Ge3Rh4
8
146
118.59
mp-28321
-1.118585
1.376574
-1.87112
other
Sc7C1I12
20
146
652.23
mp-770690
10.503675
11.781467
-0.865838
other
Mn6Te2O12
20
146
242.9
mp-686015
13.588748
6.517787
-5.399693
other
Ca21P14O56
91
146
1,282.73
mp-15751
9.369423
8.576637
3.18448
other
Ba3Y4O9
16
146
274.37
mp-1178122
5.981001
12.412519
-1.568225
other
Li8Fe16O32
56
146
597.8
mp-1228987
-4.235634
-1.397987
-6.052312
other
Al2Zn3S6
11
146
233.77
mp-1223446
7.574034
6.609656
-2.80174
other
K1I1O3
5
146
92.38
mp-33338
-6.035357
-3.383325
-2.251513
other
Li4Ga12Te20
36
146
1,119.96
mp-8974
9.473763
8.453461
3.12926
other
Ba3Dy4O9
16
146
273.79
mp-1173681
-0.232678
0.953247
-4.173167
other
Na3Gd1Br6
10
146
309.78
mp-26842
10.328943
7.833576
-6.657887
other
Ni1P3O9
13
146
200.95
mp-35320
8.786705
7.987071
-4.141331
other
Ag3As2O8
13
146
212.73
mp-685242
12.330152
7.301271
1.052281
other
Sr7Al12O25
44
146
671.67
mp-1189346
9.118108
4.647617
-3.089104
other
Sr1B12O7
20
146
268.95
mp-755478
6.557834
8.94327
-0.988988
other
Cd2Bi2O6
10
146
145.27
mp-1219495
-4.382573
-3.924857
-3.76021
other
Sm18Ga10Se42
70
146
1,788.33
mp-655631
9.156811
10.751643
-1.160254
other
Fe1Bi1O3
5
146
128.44
mp-771320
9.204462
5.482725
-6.648309
other
V3S6O24
33
146
429.99
mp-19448
9.407677
11.495789
-1.493377
other
Ni3Te1O6
10
146
103.11
mp-27453
9.611829
11.708212
0.039849
other
Li7Sb1O6
14
146
134.68
mp-674221
9.756415
13.31671
-0.811471
other
Ti5Fe15O30
50
146
532.16
mp-602393
-7.2173
-6.42569
4.358575
other
La4Ni3Pb4
11
146
297.58
mp-1101800
6.791459
6.126615
-4.001266
other
Mg1S1O9
11
146
152.79
mp-1216508
-2.834639
-2.427334
-5.938102
other
Y18Ga10S42
70
146
1,508.49
mp-1217316
9.689821
13.314087
-0.809687
other
Ti1Fe3O6
10
146
107.28
mp-1220132
-2.720093
-2.566477
-5.858164
other
Pr18Ga10S42
70
146
1,621.18
mp-1224577
-2.882445
-2.092232
-5.91956
other
Ho18B10S42
70
146
1,376.93
mp-1220699
-2.748137
-2.618238
-5.91593
other
Nd18Al10S42
70
146
1,578.24
mp-1303831
5.565654
10.586444
-1.877846
other
Mg4Fe4O12
20
146
207.6
mp-1225776
-2.659144
-2.361104
-5.948203
other
Dy18B10S42
70
146
1,390.67
mp-1226292
-5.746235
-0.693981
-4.73081
other
Cr4Se3S3
10
146
181.78
mp-771312
8.217977
6.483347
-5.625686
other
Fe3S6O24
33
146
465.19
mp-704220
10.699496
7.994836
-6.870397
other
Fe6P6O24
36
146
536.16
mp-772505
8.037182
6.509843
-5.413601
other
Ni3S6O24
33
146
471.45
mp-1217757
-2.725752
-2.559889
-5.902515
other
Tb18Ga10S42
70
146
1,498.96
mp-1226990
-4.883223
-2.87257
-4.05009
other
Cd3In2Se6
11
146
337.37
mp-772410
11.324555
4.33895
-7.838207
other
Ti3S6O24
33
146
445.1
mp-764992
11.672421
8.0903
-2.133617
other
Co29Ge13O56
98
146
1,039.66
mp-1218878
-4.302228
-4.079961
-3.827792
other
Sm18Al10Se42
70
146
1,766.28
mp-706276
10.362963
11.772504
2.447664
other
Li3Nb4O12
19
146
226.41
mp-1216518
13.125284
12.069951
-0.646571
other
V3Mo1O6
10
146
112.9
mp-1189919
9.408731
7.49972
-5.763249
other
Li3P3O12
18
146
250.16
mp-1228909
-8.198474
-4.367854
2.697906
other
Al3Si1Pd4
8
146
113.85
mp-1224705
-4.301508
-4.108963
-3.861247
other
Ho18Al10Se42
70
146
1,689
mp-1224749
-2.763397
-2.481003
-5.634174
other
La18In10S42
70
146
1,746.71
mp-772268
8.051629
6.506679
-5.518503
other
Co3S6O24
33
146
454.5
mp-1180505
6.471793
6.051477
-3.767819
other
Na4Cl4O12
20
146
451.32
mp-33738
6.964077
8.948481
-3.016941
other
Ti1Ni1O6
8
146
103.07
mp-1220191
-4.261753
-4.016171
-3.828824
other
Pr18Ga10Se42
70
146
1,844
mp-1192393
-4.749356
-5.50309
0.659982
other
Sr14Sn3As12
29
146
866.23
mp-1225125
-6.407084
-0.738544
3.862367
other
Fe3Si4Ir1
8
146
94.2
mp-1200675
7.570354
6.607157
-2.801925
other
K8I8O24
40
146
704.09
mp-1224819
-7.770465
-1.915265
2.819206
other
Ga3Si1Ni4
8
146
97.94
mp-1224805
-7.568846
-1.253223
3.632711
other
Ga3Co4Ge1
8
146
100.42
mp-1226139
-2.681761
-2.568475
-5.985396
other
Dy18Al10S42
70
146
1,460.69
mp-1192537
10.826771
11.525615
2.487689
other
Nb6Pb3O18
27
146
376.49
mp-1217749
-2.681184
-2.6256
-5.965815
other
Tb18Al10S42
70
146
1,475.4
mp-30662
-8.597092
-4.598489
2.202754
other
Zn3Ga4Pd7
14
146
209.74
mp-755969
9.542629
8.419209
2.85742
other
Sr3La4O9
16
146
301.42
mp-772423
8.052007
6.535004
-5.41998
other
Ni3S6O24
33
146
450.14
mp-1224522
-2.872778
-2.544574
-5.658332
other
La18Mn10S42
70
146
1,602.62
mp-1233757
9.214308
1.109934
0.209642
other
Mg1Cr1F6
8
146
114.14
mp-1226993
-2.907848
-2.427151
-5.528995
other
La18Ni10S42
70
146
1,538.86
mp-998527
8.699734
10.948819
-0.383314
other
Ni2Bi2O6
10
146
113.53
mp-1222341
8.391633
9.804056
-0.758388
other
Li1Ta2O6
9
146
113.32
mp-1226348
-2.69874
-2.667593
-5.929681
other
Er18Al10S42
70
146
1,440.86
mp-685197
6.056559
11.382881
0.064175
other
Sr18Ni13O42
73
146
937.79
mp-14323
9.494827
8.429144
3.194085
other
Ba3Ho4O9
16
146
269.93
mp-1228485
12.486034
8.038248
-0.012499
other
Al12Cr4O24
40
146
351.86
mp-1224838
-8.121901
-2.230439
2.78965
other
Ga4Ni3Pt1
8
146
106.95
mp-698573
9.594549
8.588898
-0.545081
other
Fe1Bi25O39
65
146
1,102.63
mp-1217771
-4.271363
-4.114199
-3.86046
other
Tb18Al10Se42
70
146
1,723.93
mp-28792
3.262696
2.858812
-4.336996
other
P4N3Cl11
18
146
487.2
mp-22995
-1.780752
0.754469
-5.121931
other
Ag3S1I1
5
146
121.86
mp-28891
10.006691
11.923968
0.707382
other
Li7Ta1O6
14
146
133.63
mp-674187
7.672527
10.780962
-0.224439
other
Ba3Ir6O18
27
146
422.93