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-1093731
-1.70487
-8.158884
2.198756
other
Ti2Sn1Mo1
4
71
858.12
mp-1097313
-2.100096
-8.643836
1.419043
other
Li1Sn1Pt2
4
71
860.28
mp-1093966
-1.996628
-8.233855
1.856821
other
Mg1Ti1Co2
4
71
774.88
mp-1068217
-8.081527
-4.966175
5.113637
other
Tb2Ni2Sn1
5
71
99.33
mp-1097575
-2.603419
-8.433449
1.773534
other
Sc2Al1Au1
4
71
1,015.64
mp-567241
-7.7101
-6.420292
3.355819
other
Pr3Ag4Sn4
11
71
303.99
mp-1208024
-8.09799
-6.39729
6.711778
other
Tm12Co5Bi1
18
71
418.32
mp-1395840
8.561593
1.526876
1.354041
other
Y1Cr1F5
7
71
121.77
mp-1207023
-7.720196
-4.46917
4.65516
other
Yb2Al1Ni2
5
71
93.18
mp-1097178
-1.636841
-8.279521
2.244541
other
Ta1Si1Tc2
4
71
762.38
mp-1225767
-7.99179
-0.006416
4.04578
other
Dy1Co10Mo2
13
71
167.27
mp-1096447
-1.619921
-8.627739
1.956952
other
Cr1Ge1Ru2
4
71
643.76
mp-1095805
-1.873243
-8.447181
2.215504
other
Zr2Re1Pt1
4
71
904.71
mp-1096032
-1.915128
-8.390771
2.16083
other
Zr2Re1Rh1
4
71
819.62
mp-1095850
-2.528089
-8.34498
1.818927
other
Li1Sc2Ga1
4
71
1,075.42
mp-1096162
-2.695987
-8.291838
1.435036
other
Mg2Cd1Ga1
4
71
1,106.59
mp-1188330
-7.860137
-3.036577
4.869175
other
Pr4Ge8Ir4
16
71
328.48
mp-1093878
-2.384876
-8.490282
1.423217
other
Mg1Zn2Rh1
4
71
901.57
mp-1096759
-1.423745
-8.328588
2.396431
other
Ti1Mo2W1
4
71
671.96
mp-1097140
-1.947356
-8.50494
1.979961
other
Si1Tc2Sb1
4
71
847.36
mp-1093931
-3.605963
-7.798676
1.74173
other
Ba2Cd1Ag1
4
71
1,950.97
mp-1095930
-1.924408
-8.383142
2.128461
other
Al1Si1Tc2
4
71
746.64
mp-1095975
-2.639267
-8.394534
1.754342
other
La1Y1Pd2
4
71
1,029.87
mp-1097289
-1.875562
-8.244241
2.18408
other
Hf2Mg1Re1
4
71
1,113.49
mp-1189829
-7.612322
-3.213949
4.462978
other
U4Ge8Ir4
16
71
306.16
mp-1097116
-3.049726
-8.151086
1.612632
other
Ca2Zn1Pd1
4
71
1,195.89
mp-1093851
-2.13053
-8.41274
1.871644
other
Zr1Be2Pt1
4
71
1,139.4
mp-1093683
-2.414435
-8.53455
1.328603
other
Zn1In1Pd2
4
71
895.46
mp-1262038
9.423022
2.750656
1.660077
other
Al1W1F5
7
71
98.7
mp-9903
-5.30341
-3.26404
5.123785
other
U3Si4Ni4
11
71
177.97
mp-1215516
-2.817102
-2.875985
-5.206671
other
Yb4Sm1S5
10
71
225.51
mp-1093740
-1.678472
-8.446043
2.177224
other
Sc1V1Tc2
4
71
817.05
mp-1093616
-3.275435
-8.518509
1.31822
other
Sr1Mg1Hg2
4
71
1,597.85
mp-570800
1.303335
1.556223
2.276992
other
U2Mn1N3
6
71
77.52
mp-1104106
-8.134182
-4.751712
4.915371
other
Ho3Ga9Pt2
14
71
256.43
mp-1095852
-2.709937
-8.554989
1.571265
other
Hf1Sn1Au2
4
71
973.15
mp-1097517
-1.545612
-8.27335
2.245779
other
Hf1Ti1Tc2
4
71
799.68
mp-1096490
-2.292171
-8.505364
1.397924
other
Mg1Cd1Pt2
4
71
893.78
mp-1103152
8.160974
1.850404
-0.918885
other
Cs2Br2F8
12
71
232.62
mp-1227648
-8.922813
-5.246379
3.601417
other
Ca1In6Cu6
13
71
228.57
mp-1097566
-2.691892
-8.456079
1.392313
other
Ca1Hg1Pd2
4
71
1,090.89
mp-1096568
-2.649512
-8.430051
1.539266
other
Li1Cu2Au1
4
71
708.75
mp-1095929
-1.497992
-8.279187
2.279342
other
Nb1V2Mo1
4
71
702.99
mp-1097412
-2.117287
-8.39215
1.95575
other
Nb1In1Co2
4
71
790.74
mp-1093792
-1.691514
-8.351712
2.197748
other
V1Re2Mo1
4
71
1,175.95
mp-1105029
-8.134796
-4.734351
4.836555
other
Er3Ga9Pt2
14
71
255.72
mp-1095721
-3.935195
-7.5234
1.736193
other
K2Na1Cd1
4
71
2,126.16
mp-1216951
-7.515518
0.581626
4.378013
other
U1Fe10Mo2
13
71
172.12
mp-1096048
-1.743643
-8.628955
2.07962
other
Li1Os2W1
4
71
743.49
mp-1219387
-7.518562
0.095283
4.808697
other
Sm1Ga6Fe6
13
71
186.73
mp-22313
8.438263
10.715175
-0.462798
other
Na2Pt1O2
5
71
67.44
mp-1097131
-2.722992
-8.355851
1.456451
other
Na1Cd2Rh1
4
71
993.88
mp-1097476
-2.223336
-8.393498
1.948585
other
Zr1Sc1Co2
4
71
1,032.54
mp-1096052
-1.991134
-8.334271
1.849855
other
Li1Al2Ru1
4
71
745.45
mp-644136
2.922961
-0.537254
-2.061139
other
Li2H2Pt1
5
71
48.89
mp-1097203
-2.607127
-8.340873
1.854415
other
Y2Al1Cu1
4
71
1,063.52
mp-1097188
-2.88212
-8.458494
1.744829
other
La2Ag1Au1
4
71
1,148.26
mp-1095957
-1.684614
-8.679543
2.074841
other
Mg1Os2W1
4
71
830.85
mp-1278503
11.544123
11.655946
-0.923873
other
Cr2Re2O8
12
71
130.46
mp-1093796
-3.316113
-8.381566
1.491873
other
Sr1Ca1Pb2
4
71
1,538.13
mp-1097284
-2.21367
-8.466663
1.407744
other
Ag1Sn1Rh2
4
71
836.32
mp-1097324
-2.290344
-8.557361
1.906683
other
Hf2Zn1Hg1
4
71
1,169.63
mp-1097374
-3.063395
-8.202099
1.918654
other
La2In1Ga1
4
71
1,382.32
mp-1093986
-2.054738
-8.29847
2.10388
other
Zr2Tl1Tc1
4
71
1,627.09
mp-1093697
-2.90363
-8.417699
1.722018
other
La1Y1Cd2
4
71
1,477.22
mp-1216626
-7.644328
0.755125
4.746773
other
Tm1Cr2Fe10
13
71
165.51
mp-1093825
-3.236668
-8.351303
1.561445
other
Sr1Mg1Pb2
4
71
1,579.62
mp-1025183
-3.382565
1.438157
2.908112
other
Ho2B4C1
7
71
80.02
mp-1096299
-3.174044
-8.32402
1.297475
other
Li2Hg1Sb1
4
71
920.4
mp-1222428
-7.491586
0.801138
4.667514
other
Lu1V2Fe10
13
71
165.82
mp-1096454
-1.648054
-8.408158
2.10773
other
Ti2Pt1W1
4
71
771.5
mp-1097434
-1.568001
-8.305467
2.310108
other
Nb2Os1W1
4
71
776.83
mp-1097499
-1.679521
-8.387172
2.262712
other
Nb1Cr2W1
4
71
790.72
mp-1095763
-1.999693
-8.39154
1.804653
other
Al2Os1Pd1
4
71
732.59
mp-1095755
-2.34427
-8.357809
1.665128
other
Y1Rh2Pb1
4
71
946.5
mp-1093685
-1.769003
-8.27357
2.235231
other
Hf1Ta1Fe2
4
71
800.28
mp-1096363
-2.444577
-8.423295
1.63667
other
Sc2Ag1Pt1
4
71
1,004.89
mp-1210568
-8.298106
-6.333496
6.512797
other
Lu12Co4Sn2
18
71
412
mp-1097259
-2.001267
-8.397283
1.62012
other
Zn1Cr1Rh2
4
71
692.48
mp-1097481
-2.794023
-8.573945
1.449376
other
La1Sb1Au2
4
71
1,191
mp-1096525
-1.49059
-8.398533
2.362467
other
Nb1Tc2W1
4
71
730.82
mp-1096190
-2.027668
-8.357991
2.034545
other
Hf2Be1Zn1
4
71
852
mp-1078775
-4.358836
1.466394
3.151445
other
Nd1Cr2B6
9
71
85.13
mp-1189485
-7.55545
-3.314108
4.457093
other
U4Ge8Rh4
16
71
304.91
mp-1093832
-2.522394
-8.418723
1.556359
other
Cd1Cu2Rh1
4
71
803.7
mp-1097204
-2.07223
-8.428652
1.680706
other
Al1Ga1Ir2
4
71
712.01
mp-1096098
-3.360035
-8.690813
1.114494
other
In1Hg2Pb1
4
71
1,345.18
mp-1096607
-2.461097
-8.570139
1.443187
other
Zn2Cu1Pd1
4
71
645.94
mp-1095995
-3.40065
-8.631024
1.066994
other
Na1Tl1Hg2
4
71
1,224.94
mp-1096742
-2.198398
-8.406481
1.615915
other
Y1Ga1Pt2
4
71
989.37
mp-1226807
9.84274
8.856242
3.195076
other
Ce2Th1O6
9
71
124.29
mp-1097100
-3.40589
-7.848593
1.727172
other
Ba1Sr1Zn2
4
71
1,614.04
mp-1096459
-2.750377
-8.439546
1.730833
other
Mg1Sc2Hg1
4
71
1,209.63
mp-1104253
-8.038807
-4.754555
5.040598
other
Lu3Ga8Cu3
14
71
244.25
mp-1097403
-2.587345
-8.22542
1.74191
other
Sr1Y1Pt2
4
71
1,216.53
mp-1097636
-2.146765
-8.538243
1.644735
other
Ti1Zn2Pt1
4
71
832.85
mp-1093913
-2.829092
-8.489437
1.51208
other
La1Zn1Ag2
4
71
1,571.26
mp-1095720
-1.593809
-8.219077
2.216041
other
Ti2Be1Mo1
4
71
784.1
mp-1093655
-2.593308
-8.277412
1.725871
other
Y2Cu1Ni1
4
71
885.8
mp-1096178
-1.449317
-8.301629
2.386831
other
Ti2Re1Mo1
4
71
726.66