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-675618
7.232804
6.038576
-3.351867
other
Sr4Ru2O12
18
14
315.54
mp-696812
5.899079
-0.155013
-3.203364
other
B12H28N4
44
14
488.48
mp-755789
12.295824
6.001582
-1.66396
other
Na4Be4O6
14
14
196.6
mp-19146
7.860414
10.026526
-3.599432
other
Cr4Pb4O16
24
14
351.58
mp-766424
10.164464
12.138891
-4.422612
other
V8O16F8
32
14
504.11
mp-1202360
9.410413
4.772074
-6.143997
other
K24S24O40
88
14
1,824.21
mp-1203084
5.95694
3.364035
-3.203329
other
C24I12N16
52
14
1,140.5
mp-779104
7.161077
8.606279
-0.506824
other
Rb16Pb4O16
36
14
843.7
mp-1369675
8.688261
0.99327
-0.246523
other
Mg4Ag4F20
28
14
393.53
mp-561582
-0.792938
1.525336
-4.116959
other
W4S4Br16
24
14
765.98
mp-1101467
13.82003
6.998612
-5.758865
other
Sn4P16O44
64
14
1,046.66
mp-764826
10.415482
0.138499
0.265994
other
Li24Mn12F60
96
14
1,089.56
mp-673069
12.8391
6.963364
-6.748463
other
Sb4P16O48
68
14
971.31
mp-29020
13.558376
7.463842
-4.84158
other
P16Se4O24
44
14
864.29
mp-672981
10.045456
7.555698
-5.956117
other
Bi4P8O28
40
14
647.1
mp-27479
10.848555
11.211771
-1.487337
other
Pr8W8O36
52
14
679.54
mp-1211988
8.490032
1.110362
0.46847
other
In2Ag6F12
20
14
322.84
mp-1202556
6.247869
4.995571
-4.649194
other
Tb4N12O36
52
14
653.65
mp-14283
8.582383
1.173051
1.360833
other
Sr8In4F28
40
14
557.45
mp-649509
7.980901
7.275394
-4.26355
other
Yb8Se12O48
68
14
1,264.93
mp-1199652
9.28559
7.03146
-3.224634
other
Mg8B8O24
40
14
417.86
mp-1211006
8.479894
1.642088
-0.047269
other
Lu4Pt4F28
36
14
476.11
mp-1199062
1.630544
2.408296
0.046646
other
Rb12Yb4N24
40
14
1,093.52
mp-1020057
9.573168
8.691933
2.945937
other
Li4La4O8
16
14
212.5
mp-1181349
9.20731
3.397616
-5.288855
other
H12C4O12
28
14
276.58
mp-1192909
8.418407
8.001399
-3.069625
other
U4Bi4O20
28
14
455.89
mp-561547
12.665198
6.3135
-0.232134
other
Sr8Si8O24
40
14
565.43
mp-1197364
7.922314
6.259097
-5.077498
other
Bi4S4O24
32
14
628.2
mp-1323594
8.277665
1.354299
1.191072
other
Mg4Bi4F20
28
14
461.86
mp-554631
12.534969
7.006907
-6.885128
other
Sb8P12O48
68
14
917.51
mp-772769
11.705106
7.25316
-0.856132
other
Na8Ge8O20
36
14
552.96
mp-554033
12.97317
6.160039
-0.679933
other
Na24Si32O76
132
14
1,838.06
mp-642216
12.782013
7.003185
-0.73874
other
Mg8Si8O24
40
14
391.21
mp-13602
11.107196
7.494617
-3.746386
other
Cd12As8O32
52
14
739.15
mp-558065
13.013421
5.993092
-7.006461
other
In16P24O84
124
14
1,725.02
mp-1182442
8.15555
2.821983
-1.547457
other
B4O8F12
24
14
339.04
mp-1191173
8.206651
6.283291
-5.306859
other
Cs4S4O16
24
14
488.61
mp-756919
11.845305
7.013004
-4.227904
other
Mg6As4O16
26
14
344.46
mp-1202763
7.758778
7.492127
-3.975712
other
Mg4W4O24
32
14
517.38
mp-1189088
7.143474
7.670923
-3.80785
other
V2Cl6O12
20
14
329.72
mp-1246744
0.820647
2.209377
1.743043
other
Sr4Ru4N8
16
14
252.1
mp-19096
11.232782
10.446607
0.993641
other
Ba8V4O16
28
14
491.44
mp-1198523
7.178912
5.459692
-4.59667
other
Mg4C4O24
32
14
442.74
mp-30163
11.193067
10.940155
-3.98426
other
La8Mo16O60
84
14
1,292.26
mp-640748
5.732682
3.366914
-4.69074
other
Os12C48O48
108
14
1,796.03
mp-657234
1.307228
2.348842
-5.576418
other
K12Ti4Cl24
40
14
1,316.56
mp-4172
-3.43236
-4.577264
0.769226
other
Na20Ge4P12
36
14
768.63
mp-1020193
6.287291
4.934707
-4.469105
other
K4N4O12
20
14
315.28
mp-765753
6.549862
9.581681
-2.429775
other
Na4Mn4O16
24
14
351.62
mp-1198592
13.259806
4.376647
-2.880147
other
B12H12O24
48
14
416.65
mp-767625
9.973305
2.448647
1.535224
other
Li4V4F16
24
14
331.2
mp-1202449
9.210146
6.566296
-5.887997
other
Na8P8O32
48
14
849.71
mp-1210570
7.323094
6.676307
-3.674218
other
Ni4Se4O20
28
14
418.29
mp-30280
-5.928623
-3.19931
-1.616118
other
K16Ti12Te36
64
14
2,245.28
mp-26566
9.248296
7.952921
-5.577633
other
Fe4P8O28
40
14
544.83
mp-29990
2.432418
2.034512
1.643128
other
La24B16N40
80
14
1,094.66
mp-1204298
7.352487
7.872972
-3.515487
other
Sr8B16O64
88
14
1,240.27
mp-775372
-5.251885
-4.039368
-2.543269
other
Li40Sb8S8
56
14
1,122.23
mp-752776
10.041591
11.985944
-4.550469
other
V4O8F4
16
14
214.4
mp-560370
-3.392083
-1.76243
-5.624229
other
Ge4Pb8S16
28
14
741.82
mp-31378
7.785914
9.980594
-3.81514
other
Cs8Cr16O52
76
14
1,509.72
mp-1209396
-2.789748
-2.51475
-5.903485
other
Pr8Si4S20
32
14
736.24
mp-754729
14.967559
12.475453
-0.879454
other
V6O8F4
18
14
188.98
mp-672376
2.419526
2.877067
-4.600536
other
Re8Cl28O12
48
14
1,150.87
mp-28192
1.888751
2.758659
-4.430528
other
Au4S4Cl20
28
14
798.08
mp-730380
8.038077
6.326114
-5.271328
other
Ce8S12O64
84
14
1,268.38
mp-1202817
8.627835
6.329962
-3.691772
other
Mg4B24O64
92
14
1,185.26
mp-3764
12.080862
7.897153
-4.288556
other
Te12P8O44
64
14
894.3
mp-778228
11.649816
11.099339
-2.430614
other
Gd8W12O48
68
14
1,517.68
mp-759388
12.614311
7.379956
-6.976682
other
Ni4P16O44
64
14
847.4
mp-1106094
7.812188
5.047075
-6.002778
other
K4C4O12
20
14
350.46
mp-1200186
13.386476
5.926843
-6.866746
other
Tm12P36O108
156
14
2,288.9
mp-605048
7.763918
1.152681
-4.299636
other
H104C80N16
200
14
2,009.4
mp-24270
6.403984
0.407883
-3.453268
other
K8B40H40
88
14
960.61
mp-1205237
5.544442
2.26611
-3.156044
other
Ti12C240Cl48
300
14
4,769.05
mp-1004038
8.612574
14.229021
-0.168084
other
Ca4Mn8O16
28
14
360.76
mp-27389
8.46568
1.839456
0.407935
other
K4Sb8F28
40
14
651.8
mp-12199
11.543219
7.200856
-5.069623
other
Hg12P8O32
52
14
718.95
mp-1246347
1.921767
1.961793
0.836933
other
Na12Y4N8
24
14
537.63
mp-559204
8.028838
0.688221
-4.465933
other
H24C8S8
40
14
549.45
mp-1192397
-3.508459
-1.563719
-5.879829
other
Si4Sn8S16
28
14
714.71
mp-28568
8.398219
8.631862
-0.169028
other
Rb12Cu4O8
24
14
567.93
mp-679949
-2.730148
0.692386
2.575476
other
La30B28C38
96
14
1,474.06
mp-1193962
6.139327
5.224948
-4.253479
other
As4N8O16
28
14
568.59
mp-777679
10.215099
0.55573
0.375423
other
Li4Fe4F16
24
14
305.24
mp-16993
11.773695
7.27351
0.796114
other
Er8Si4O20
32
14
388.03
mp-1245427
0.532383
2.65295
1.711537
other
Mn12Ni32N36
80
14
829.22
mp-1182482
5.990995
5.123006
-4.250005
other
As4N8O16
28
14
598.52
mp-1211553
7.83044
9.566005
-3.765581
other
Lu8Cr8O40
56
14
747.98
mp-560169
5.645983
2.944021
-3.80062
other
C8S16N16
40
14
713.15
mp-1019733
6.251974
5.152371
-4.574618
other
Eu4N12O36
52
14
693.46
mp-759429
10.299994
0.878633
1.586647
other
Li12Mn8F28
48
14
627.63
mp-700127
12.94282
10.490918
-0.032601
other
Pr10Mo64O108
182
14
2,565.25
mp-1203326
1.370334
2.281707
-5.137423
other
Ga8Hg12Cl32
52
14
1,718.62
mp-753782
9.780106
2.2428
0.479013
other
Li4V4F20
28
14
372.09
mp-1180792
6.900209
6.105486
-3.818573
other
K4Te4O28
36
14
730.26
mp-1178475
8.821846
8.527986
-0.038737
other
Cs20Y4O16
40
14
1,132.55
mp-27100
9.147961
7.829465
-5.603502
other
Cr8P12O52
72
14
941.08
mp-662570
8.606228
1.598239
0.158419
other
Ba8B16F64
88
14
1,397.5
mp-1198351
11.237042
10.941124
-3.979059
other
La24Mo48O180
252
14
3,788.87