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-1220435
-4.612338
-1.230461
-2.610366
other
Nb6Tl1Se8
15
147
315.34
mp-1207877
6.887018
8.186982
-3.031322
other
Zn8S2O28
38
147
608.98
mp-849362
8.920229
9.747253
0.0202
other
Na28Co4O18
50
147
720.73
mp-28940
10.381239
10.181893
3.403338
other
Sr8Nb4O18
30
147
488.65
mp-1220487
-6.138655
-1.712026
1.338689
other
Nd2P7Rh12
21
147
308.65
mp-726886
9.108377
7.310083
-5.29989
other
Cd3P6O24
33
147
725.62
mp-550479
9.990619
10.360184
-3.460824
other
Co2Re4O16
22
147
350.93
mp-1219673
-4.795978
-1.618935
-2.960989
other
Rb1Ti6Se8
15
147
313.48
mp-1216802
-4.822002
0.219764
-4.551979
other
Tl1V6S8
15
147
238.46
mp-1229220
-3.99175
-0.476608
-3.199679
other
Cs1Nb6S8
15
147
286.8
mp-1226432
-4.82716
0.206148
-4.492681
other
Cs1V6S8
15
147
247.31
mp-676371
-5.807939
1.319198
-4.804889
other
K5Mo24S28
57
147
1,183.2
mp-1215912
-6.311405
-1.745757
1.238044
other
Yb2P7Rh12
21
147
308.17
mp-758234
12.075418
6.641385
-4.798583
other
P12Pb18O48
78
147
1,263.21
mp-775315
11.565287
7.349079
-1.577801
other
Si12Bi18O52
82
147
1,164.75
mp-1227422
-6.083528
-2.005292
1.467474
other
Ca2P7Ir12
21
147
315.1
mp-28729
8.798162
8.790944
-1.127099
other
Ag25Bi3O18
46
147
765.99
mp-1220463
-4.528758
-1.153322
-2.562889
other
Nb6Cu1Se8
15
147
304.42
mp-1213478
7.559574
7.56337
-4.294538
other
Cu7S2O21
30
147
409.18
mp-1229235
-4.785743
-1.680042
-2.981594
other
Cs1Ti6Se8
15
147
318.78
mp-1216134
-6.148801
-1.611939
1.31699
other
Y2P7Rh12
21
147
303.06
mp-1225373
-6.170328
-1.637497
1.300022
other
Dy2P7Rh12
21
147
302.74
mp-891955
10.871771
12.258621
-3.319866
other
Ca10V6O25
41
147
592.22
mp-1221437
-5.383043
-2.043893
-1.462468
other
Na1Nb6Te8
15
147
370.71
mp-505490
-5.117252
-6.089959
0.480887
other
Rb24Sn6Sb36
66
147
2,992.35
mp-1104760
1.512636
1.926551
1.983017
other
Li6U3N6
15
147
175.14
mp-1214193
3.437398
-0.683464
-2.556419
other
Ca9Al18H72
99
147
1,293.31
mp-560756
11.456792
11.064732
-3.907725
other
Th9Mo18O72
99
147
1,768.4
mp-1220950
0.901647
1.275221
-4.374637
other
Na1Pr2Cl6
9
147
219.18
mp-1220447
8.236037
12.488911
-0.320613
other
Nd1Fe3O6
10
146
116.64
mp-1220655
-4.2668
-4.147345
-3.879521
other
Nd18Al10Se42
70
146
1,797.6
mp-1220718
-2.802307
-2.549449
-5.875521
other
Nd18Ga10S42
70
146
1,591.96
mp-530449
11.802538
7.005886
-3.891029
other
Ca21As14O56
91
146
1,322.36
mp-1182608
-7.5911
-4.41571
5.50041
other
Ce10Al4Ru6
20
146
457.5
mp-1273627
11.499059
12.966424
-1.904283
other
V2Ni2O6
10
146
102.6
mp-530846
10.57737
12.071891
2.475983
other
Li15Nb16O48
79
146
892.96
mp-1272388
6.590567
13.293778
-1.609302
other
Fe2Ni2O6
10
146
101.27
mp-623035
-6.736693
-3.484253
0.948061
other
Fe4Sb4Pt4
12
146
241.96
mp-1227612
-4.278017
-3.932512
-3.780994
other
La18In10Se42
70
146
1,967.89
mp-1220043
-2.652518
-2.633005
-5.899558
other
Pr18Al10S42
70
146
1,606.55
mp-685353
9.703649
8.550081
-0.658571
other
Bi60P4O100
164
146
2,766.12
mp-1224821
-8.115113
-2.237559
2.766518
other
Ga4Ni3Pd1
8
146
106.85
mp-686175
9.634593
8.577042
-0.546964
other
Si4Bi60O100
164
146
2,690.35
mp-1225990
-2.804323
-2.548163
-5.806308
other
Er18Ge8S42
68
146
1,443.34
mp-1226283
12.448227
10.731428
-0.5794
other
Cr1W1O3
5
146
113.26
mp-1228012
-4.027179
-1.837114
-5.085581
other
Bi38S54Br6
98
146
2,559.92
mp-771768
8.030677
6.509111
-5.482498
other
Co3S6O24
33
146
467.84
mp-673047
9.013659
7.684011
-5.512617
other
Cu6P6O24
36
146
532.26
mp-757785
9.587457
8.557904
-0.521865
other
Bi12Pb1O19
32
146
564.59
mp-771239
8.476008
6.297188
-5.842877
other
Mn3S6O24
33
146
434.22
mp-31408
13.81097
4.334625
-2.052435
other
Al4B6O15
25
146
243.88
mp-548231
9.395784
11.045611
-0.246655
other
Fe2Bi2O6
10
146
116.81
mp-675295
8.923082
2.646584
1.034033
other
In1P1F3
5
146
123.86
mp-531132
13.387235
5.309974
-6.262564
other
Ca21P14O56
91
146
1,210.42
mp-36383
9.097326
7.838966
-5.207745
other
Ag3P2O8
13
146
188.55
mp-532028
10.814953
12.337366
-3.37327
other
Ca21V14O56
91
146
1,322.26
mp-754389
13.077818
0.427953
0.807845
other
Fe3O3F3
9
146
111.2
mp-1222906
-2.881292
-2.132441
-5.913295
other
Lu18B10S42
70
146
1,319.4
mp-504281
8.957061
7.862433
-5.528904
other
Ni6P6O24
36
146
519.79
mp-1227984
-3.964388
-1.815146
-5.080491
other
Bi38S54I6
98
146
2,617.46
mp-552941
8.809914
3.815443
-7.382495
other
Na4C1O4
9
146
114.99
mp-937761
7.621122
11.441322
-0.846539
other
Li7Zr1O6
14
146
141.3
mp-1223204
-1.115565
1.170137
-1.579282
other
La7Co1I12
20
146
846.8
mp-1224859
-7.705657
-1.672214
2.732864
other
Ga1Ni4Ge3
8
146
103.41
mp-1226313
12.768928
10.924746
-0.34755
other
Cr1Mo1O3
5
146
60.33
mp-775739
8.246348
14.257548
-1.666486
other
Li1Mn28O56
85
146
981.42
mp-1226663
-2.688499
-2.404867
-5.888544
other
Er18B10S42
70
146
1,358.36
mp-760311
9.565128
9.104079
0.129582
other
Na7Sb1O6
14
146
189.6
mp-1216522
12.626655
12.9756
-1.027547
other
V3Ni1O6
10
146
103.78
mp-756194
13.650584
4.384207
-1.614851
other
Tm4B6O15
25
146
358.19
mp-550314
8.216683
4.271829
-6.411118
other
Rb4C1O4
9
146
195.09
mp-758121
8.125317
4.401026
-6.86136
other
Fe4C6O18
28
146
347.03
mp-1226050
-4.315831
-4.082944
-3.851914
other
Dy18Al10Se42
70
146
1,696.87
mp-680170
-3.401959
-0.666055
-4.935028
other
Cs6Ti6S27
39
146
1,100.45
mp-1216327
-6.386145
-0.677053
3.843269
other
V1Fe3Si4
8
146
93
mp-531213
8.650592
1.294994
1.955916
other
Ca13Y6F43
62
146
823.62
mp-1223537
-4.336706
-3.865197
-3.771883
other
La18Ga10Se42
70
146
1,889.11
mp-1225354
5.911183
11.640135
-2.218351
other
Fe8Si2O18
28
146
375.49
mp-1102637
6.760388
6.218404
-3.838538
other
Mg1Se1O9
11
146
154.27
mp-752471
6.356968
11.716146
-1.598196
other
Li7Fe1O6
14
146
124.41
mp-686088
14.450348
6.779373
-6.317494
other
Nb8P15O56
79
146
1,195.3
mp-1223592
-2.649607
-2.568244
-5.816034
other
La18Al10S42
70
146
1,640.58
mp-758396
8.057942
4.432513
-7.005474
other
Mn4C6O18
28
146
361.48
mp-27313
8.333941
2.092879
-0.800183
other
Nb4Se4F36
44
146
672.46
mp-754060
7.039476
11.059507
-1.274209
other
Li7Bi1O6
14
146
136.48
mp-1224774
-2.735823
-2.46941
-5.732599
other
La18Ga10S42
70
146
1,658.12
mp-694547
10.378852
7.964692
-7.046526
other
Mn6P6O24
36
146
555.72
mp-1220064
-4.175828
-4.164646
-3.906434
other
Pr18Al10Se42
70
146
1,827.34
mp-37399
9.868161
11.939919
0.662704
other
Li7Nb1O6
14
146
134.24
mp-1220629
-4.349801
-3.991652
-3.822218
other
Nd18Ga10Se42
70
146
1,828.12
mp-1224863
-7.373614
-1.121219
3.375684
other
Ga1Co4Ge3
8
146
97.87
mp-8261
7.275722
8.674029
-0.881734
other
Ba3Yb4O9
16
146
279.38
mp-775149
11.289061
4.331336
-7.796047
other
Ti3S6O24
33
146
439.76
mp-773014
8.473713
6.281036
-5.836046
other
Mn3S6O24
33
146
442.65
mp-1216384
-2.802191
-2.498701
-5.98489
other
Y18Al10S42
70
146
1,471.48
mp-2228518
7.054325
13.437462
-1.85013
other
Mg1Co5O8
14
146
143.32
mp-680394
-7.45844
-6.993443
2.932462
other
Ca24Al8Cd136
168
146
3,977.82
mp-690518
6.201757
13.408854
-2.199887
other
Na1Co3O6
10
146
100.25
mp-1101924
6.986676
7.207676
-3.913621
other
Ni1S1O9
11
146
188.15
mp-36381
-2.584346
-0.48373
-5.323832
other
Sn1P2S6
9
146
214.63