formula
stringlengths
2
15
target
float64
0.01
205
Au1K1Se1
0.907973
C60K6
6.19389
Re1
35.0688
Au1Sc1
5.82201
Fe1Ga1Ni2
3.80311
Ag1Bi1Yb1
1.2386
Ho1Rh1Sn1
2.50927
In2Sr1Te4
1.00722
Ga2Zr3
7.08747
Ag2Mo1O4
1.57588
Li2Mg8Si4
2.0204
B1Ta2
29.4818
Ba3Pb5
0.570515
P2S6Th1
2.32028
F3Mo1
5.13902
Al2Yb1
6.13359
Cu2Sc1
5.68982
Ge1Zr1
7.72131
Se1Sr1
6.93557
Ba1Cd1
2.05258
Al1Mg1Y1
6.97072
Si1Sn3Zr5
5.08217
Ba1Pb1Zn1
1.68172
Ge13Rh4Tb3
1.70127
Ru2Sb2Sr1
6.10603
Co1S1Sb1
5.42072
Ca3Co4Sn13
0.422065
Ru1Y3
2.54817
Ba3Mn1N3
0.460238
Al3C3Er1
16.322
As1Dy1Pd1
2.61748
Er1Ir1
8.50438
Ba1Li1Si1
4.26982
Al1Li5O4
5.39709
P1Pt1Y1
6.92832
Os2Si2Tb1
12.8169
Bi1Pt1Yb1
2.30427
P1
24.2209
Al5C3N1
13.3806
B1La1Rh3
5.12828
Mg3P2
5.51334
Hg1Ti1
4.04016
Cu2Li1Si1
4.6008
Ag1Dy1
3.90426
Al1C1Zr2
17.851
Be13La1
12.1915
Br5Cs1Sn2
0.637468
Cu7Hf6Zn16
1.2395
Al6Tc1
7.34628
Al1Mo3
13.9255
Rh1Si1Zr1
8.0171
Ba2O4Zr1
6.45536
Ba1Cl2
0.736002
Os1Si1Zr1
8.37185
Ag1Br2Cs1
0.270806
Mg6Ni16Si7
3.36294
As1Pd1Sr1
2.19356
C1Os2Zr4
3.71752
Er2O7V2
5.47783
Au1Ta3
4.16073
Al3C3Sc1
20.3263
Ge2Rh2Y1
7.34652
O4Pr1V1
4.8759
Au2In1Ti1
0.771056
Al1Er1
3.5155
As1Pd1Se1
1.48111
In1Li2Mg1
3.0271
La1Si2
3.24016
Ho2Rh3Sn5
1.1783
Fe2S6Ta9
4.48893
Al1Li1Te2
1.53133
Co2Ga1Hf1
18.748
O4P1Y1
8.73884
Ca1F3Rb1
2.66995
Cu1Hf5Pb3
2.16858
Ga1Li1O2
4.67502
Lu1Pt1Sb1
5.6581
Pt1Zr2
0.895417
As2Hg1O6
2.8438
In1La1
3.68961
Au1Cd1La1
0.535871
P1Tb1
20.481
Ag2Ca1Ge2
1.74161
Sr1Tl1
1.64671
Ir1N1
6.80966
As1Zr1
7.56445
As2Pt1
4.02786