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-616625
3.185733
3.165884
-4.405154
other
Mo4P4N4Cl24O8
44
14
1,146.87
mp-24182
10.202608
4.611323
-4.5379
other
Rb4Zn2H24Se4O28
62
14
753.01
mp-1199397
10.023435
2.527891
-2.773072
other
Ni2Sb4H24O12F16
58
14
620.06
mp-1203230
7.750187
0.476825
-4.523363
other
In4H48C16Se8I12
88
14
1,915.36
mp-23911
10.475994
3.455901
-4.503041
other
Mg2H40S4N4O28
78
14
711.33
mp-759772
9.385594
2.277381
-0.265152
other
Sr8V4C4O12F20
48
14
677.72
mp-2647154
6.598273
-0.02598
-3.723807
other
Lu4B12H72C8S4
100
14
963.42
mp-1173532
12.309581
6.585425
-0.149893
other
Nd8Mg4Ti6Si8O44
70
14
849.47
mp-1197451
7.842273
0.201554
-4.462725
other
Ni8P16H168C56Cl8
256
14
2,994.41
mp-1199114
11.357856
4.244683
-4.954259
other
Pu4P8H24C4O32
72
14
759.25
mp-622196
4.685572
2.732573
-3.643698
other
K4Hg4C12S12N12
44
14
945.74
mp-1197302
7.889725
0.395132
-4.502652
other
Cu4H72C24Se8Cl16
124
14
1,852.83
mp-734828
5.644937
3.311254
-4.660717
other
Co4H4Ru12C52O52
124
14
1,994.08
mp-1201390
8.117483
3.497761
-4.842618
other
Cu2H24C4N12O24
66
14
759.4
mp-1197934
13.780786
6.936453
-6.527128
other
Sr4Mn6P8H4O32
54
14
679.57
mp-1202356
5.318122
4.333962
-4.025085
other
Na8Cr2C12N12O20
54
14
938.57
mp-1198826
8.305498
0.888457
-4.472312
other
H40Pt4C8N8Cl8
68
14
826.94
mp-1214702
8.151808
2.880096
-1.347807
other
Be4Tl4Zn2O12F16
38
14
517.43
mp-707879
9.950913
3.285849
-3.814344
other
K4Cu10H16Cl16O12
58
14
924.77
mp-1182658
8.565949
4.660981
-4.210777
other
Cr4Ni2H40N4O28
78
14
2,292.57
mp-768707
9.035932
4.746649
-8.434467
other
Li8Fe4P4C4O28
48
14
550.89
mp-1204413
11.688154
4.23531
-5.138062
other
Mn6P8H24N4O32
74
14
766.21
mp-1195319
8.15215
1.978992
-4.553611
other
H24C12S4N8O8
56
14
781.75
mp-720469
5.581372
3.179399
-4.634938
other
H24Os20Pt8C68O68
188
14
3,113.01
mp-720868
10.127911
3.096795
-3.832781
other
Ca4Cd2H48Cl12O24
90
14
1,060.33
mp-616240
4.658432
2.751453
-3.573864
other
K4Pt2C8S8N8
30
14
765.22
mp-1196019
8.958532
3.996742
-5.397475
other
Na4S8N4O16F8
40
14
622.61
mp-1215113
6.314268
4.151729
-4.165907
other
Ba4Re8C12N24O44
92
14
1,829.09
mp-1214791
8.242267
2.650678
-1.307475
other
Be4Tl4Ni2O12F16
38
14
626.2
mp-1196899
10.237619
2.514578
-3.844441
other
Co2H16N4O4F8
34
14
292.33
mp-1212348
9.216353
1.701034
-1.047108
other
K4Be4Ni2H12F16
38
14
519.11
mp-1212027
10.413297
4.566128
-4.222469
other
La8Mg2Si8C8O44
70
14
856.54
mp-1211082
8.895673
3.549337
-5.93409
other
Na8Cr4H20C16O44
92
14
1,098.79
mp-1204594
8.654422
7.613194
-4.564673
other
K4U4P4O28F4
44
14
746.2
mp-1203987
7.895453
0.262289
-4.46007
other
Co4P12H132C44I4
196
14
2,308.01
mp-759686
12.714264
6.080303
-1.457509
other
Be4Al4Si4H4O20
36
14
322.15
mp-510449
10.399883
3.490462
-4.543344
other
Co2H40S4N4O28
78
14
705.34
mp-758128
8.601906
3.626575
-6.114604
other
Na4Co4H8C12O28
56
14
650.99
mp-1195353
8.651741
3.541569
-6.179411
other
Na4Zn4H8C12O28
56
14
668.73
mp-736665
3.254887
2.809833
-4.096866
other
Hg8H8C8N4Cl20
48
14
1,372.63
mp-680168
-3.041308
0.557383
-3.452316
other
K8Re12C8Se20N8
56
14
1,351.18
mp-1204821
10.30553
4.634319
-4.498356
other
Tl4Zn2H24Se4O28
62
14
753.88
mp-706605
8.754208
3.581028
-5.740994
other
K16Zr4H40C32O84
176
14
2,300.1
mp-24606
9.43784
3.474881
-5.816912
other
Rb4Mg2H16C4O20
46
14
522.83
mp-1199327
10.052474
3.209953
-4.357709
other
V4Te4H44N8O32
92
14
843.67
mp-553947
9.49072
7.021506
-3.337735
other
Sr8Ni4Se8Cl8O24
52
14
839.83
mp-1238483
9.174425
1.664361
-0.961177
other
K4Be4Ni2H12F16
38
14
534.45
mp-1198334
10.740142
4.220381
-4.924877
other
Tl4Fe2H24S4O28
62
14
733.18
mp-1198103
-3.027988
-1.004431
-4.873489
other
Cu4As28P4S28Br4
68
14
1,895.49
mp-778123
13.155759
6.500968
-6.488242
other
Li4Mn6P8H8O32
58
14
668.4
mp-740736
11.150444
3.579497
-4.815679
other
Na4P12H40N8O40
104
14
1,072.23
mp-1196538
7.682138
0.424224
-4.301614
other
U4B24H144C24N12
208
14
2,047.18
mp-1199019
8.132551
2.330438
-1.114341
other
Ag4Sb4S4O8F24
44
14
751.26
mp-1201487
11.221646
4.24926
-5.273314
other
Ag12P12H12N12O24
72
14
912.28
mp-1214088
8.687374
2.744127
-4.752346
other
Co2H40C8N20O24
94
14
959.74
mp-1196799
9.088528
3.254498
-4.257789
other
H96Rh8N32Cl12O60
208
14
2,108.87
mp-636952
8.185221
3.48361
-3.735337
other
Li4C4S4O12F12
36
14
510.53
mp-1215033
7.01548
2.544257
-3.134406
other
B4C96Br4N24F48
176
14
2,357.21
mp-1212661
8.166124
2.531393
-1.205982
other
K4Be4Cu2O12F16
38
14
572.94
mp-1201463
12.730883
5.568834
-5.752771
other
K8Mn6P12H16O48
90
14
1,112.21
mp-1193732
10.187975
8.924563
-1.968784
other
Te4Pd2Pb4Cl4O12
26
14
509.88
mp-728656
8.480279
2.083893
-4.617366
other
Co4H64C16N28O28
140
14
1,222.04
mp-1201414
9.190284
1.825561
-4.182707
other
Co4H72N24Cl12O12
124
14
1,198.68
mp-1200256
8.575519
4.278207
-4.529665
other
Ag4C4S8O24F12
52
14
783.33
mp-707811
9.993219
2.040653
-3.235595
other
Zr4H24N4O4F20
56
14
548.96
mp-1211102
9.949862
4.281588
-6.555891
other
Nd8Mg2Si8C8O44
70
14
891.98
mp-766592
9.228527
3.948656
-8.47688
other
Li12Ni4P4C4O28
52
14
522.65
mp-1223694
10.824542
12.186243
-3.532386
other
K4Ba4V12Cd8O44
72
14
1,169.66
mp-780200
12.761117
5.849027
-5.530266
other
Li4Fe4P4H8O20
40
14
423.74
mp-555814
9.237322
10.264327
-1.047981
other
Sr4Cu4Te2Br4O12
26
14
474.97
mp-555482
9.194851
1.693995
-0.063826
other
K8Zr8H16O8F40
80
14
1,060.55
mp-1210745
9.530917
4.962721
-6.117296
other
Na4Cu2H4S4O16
30
14
358.23
mp-542417
10.587039
4.077613
-5.040449
other
Cs4Mg2H24S4O28
62
14
749.54
mp-505662
4.209623
2.301252
-3.239474
other
Cs4K2Co2C12N12
32
14
709.36
mp-553936
6.277819
5.073534
-4.434956
other
K4Ag8Pd6N24O48
90
14
1,364.24
mp-1199629
12.409925
5.21875
-5.489501
other
Ba4Cd2P8H12O32
58
14
699.28
mp-1204707
11.924222
5.060781
-5.359862
other
Fe12P16H32N4O48
112
14
1,216.36
mp-1194403
9.343617
7.236421
-3.046288
other
Pd2Pb4Se4Cl4O12
26
14
478.57
mp-768645
9.006739
4.743263
-8.436596
other
Li8Fe4P4C4O28
48
14
548.98
mp-1212675
8.362039
2.446972
-4.686309
other
H28C8S4N20O12
72
14
888.76
mp-1210318
7.161969
5.822412
-4.476605
other
Na4C4S4Cl12O16
40
14
794.63
mp-1212673
9.089453
2.760743
-4.956227
other
H24Pd2C8N4O20
58
14
628.39
mp-603609
10.148056
3.153476
-3.933408
other
Al2H40Ru2Cl12O20
76
14
859.87
mp-771918
14.039162
7.573028
-7.097576
other
Li16Mn8P8O32F8
72
14
777
mp-1214276
12.049229
5.699249
-4.6215
other
Ca4Mg2As4H8O20
38
14
401.65
mp-735626
11.532907
6.587308
-6.596825
other
Ca8Mn12P12H24O68
124
14
1,417.39
mp-1201562
5.523239
2.813157
-3.502967
other
Ni4C56S8N8O12
88
14
1,435.32
mp-1196436
12.707886
4.299161
-3.107966
other
La4B20H20N4O56
104
14
1,110.61
mp-1214165
6.279459
4.50773
-4.493594
other
Cd2C4S4N12O12
34
14
745.56
mp-1204779
1.244038
2.209483
-5.133583
other
Al8Bi28Ru4Br8Cl32
80
14
2,692.71
mp-1211072
7.752478
1.923501
-4.805631
other
Mn4H12C8N36O4
64
14
693.04
mp-562378
10.251415
9.458089
-1.947493
other
Sr4Co8Te12Cl8O32
64
14
1,152.69
mp-698056
10.353694
4.277688
-5.870443
other
Na4Cd2H8S4O20
38
14
428.23
mp-726129
13.561551
6.852793
-7.088374
other
Li4Ti8Co2P8O40
62
14
696.28
mp-705033
5.734434
3.361411
-4.632352
other
Cr8As4C40Cl4O40
96
14
1,700.57
mp-604970
7.850604
0.147886
-4.534239
other
Ga4Si16H120C40Cl4
184
14
2,131.12
mp-1201159
9.713438
5.587618
-4.33049
other
Na4Mn2H8Se4O20
38
14
460.16
mp-1210299
8.083795
2.833627
-1.634256
other
Rb4Be4Cu2O12F16
38
14
594.08
mp-1194865
12.053109
7.100078
-7.367853
other
K4Mg4Fe4P8O32
52
14
692.49
mp-651806
5.679089
3.333391
-4.555331
other
In8Re16C80Cl8O80
192
14
3,561.67