formula
stringlengths
2
15
target
float64
0.01
205
Ru1Se2
5.15647
Pd3Tl1
1.70548
C3Ir5
2.33863
N2Sb1Th2
6.64039
Ba2Si46
1.81725
C20
45.1463
Al20Pr1V2
2.12337
O3Pb1Zr1
9.84373
As1Cu1Sr1
4.28626
Hg1Y1
3.12497
Cd1Se4Yb2
0.291692
Y1
20.2194
Ba1Br1H1
1.23482
N4Si3
17.9999
Ca2H6Ru1
6.92414
S7Tb5
3.31136
Er3Ga1O6
3.74371
Sb1Sc2
5.29646
Bi1Pt1Se1
1.11989
Ni1O6Ta2
7.28957
Al2La5Ru3
1.54783
Be1S1
41.9903
B2Ca1Rh3
12.1029
Au3Sr7
0.312061
B1Mg8Pt4
1.26451
Cu1Li2Sb1
3.69209
Pd1Sc2
1.54415
In1Sc2
5.44216
Fe1Nb4P1
9.62027
C2Cr1Sc1
25.97
Ni4Sc1Sn1
1.61226
Cl1Rb1
0.953933
Sb3Yb5
1.33791
Hf1Sb1
4.34719
C1Ga1Sc2
10.0791
Ir1Ti3
1.85335
Er1Ni1Sb1
8.97715
Ir1P1Sr1
1.99826
S3Sn1Sr1
1.40428
Ge1Mg2
1.66237
H2V1
15.6751
Ni1Sb1Ti1
8.31049
Be2Cs1F5
0.322151
Na6O5Pb1
1.94195
Ni16Si7Ti6
3.80291
Ho4In1Rh1
1.57004
Ag2In1Tb1
1.21622
B2Be1C2
31.6826
Au1Tb2
0.969947
N1Tc3
28.7143
Er2Mg1Se4
1.39993
C3Sc4
9.93357
Er1Ir2
7.24662
Co1Sc1
19.4033
As2Ba1Zn2
1.32349
Ho1Ir1Si1
5.10476
Ge6Ir7Y4
4.91547
Cd1In2O4
2.44492
As1Ca1Rb1
1.4068
Sb4Zr5
2.404
La1Pd5
2.55608
Rh1Sn1Y1
2.60334
Al1C1Y3
16.7498
Se1Zn1
5.41495
S4Tl3V1
1.32044
Al2Cu1Mg1
4.85163
Si2W3
5.99699
O2Rb2
1.46816
P1Tl1
3.15928
Co1Ti1
28.3162
La1Pt1
2.43181
Bi1O2Y2
6.52619
Al2Ru1
15.7209
Au1Gd1
2.34303
Dy3Rh1
0.729881
Li1Mg8Si4
4.84755
Al1La3
2.3293
C1Mo1
58.0923
Nd1Pt3
3.23184
Al18Mg3W2
2.38748
Ho1Rh1
7.32271
Dy1Li1O2
4.09064
Ga3Ru1Y1
3.17841
Hf2Ni2Sn1
4.57668
B4H16Hf1
13.1745
Al3Zr4
15.2362
Ru1Ti1
37.9796
Os1Si1
8.31694
Dy1Ge1Ni1
3.45402
La1Mn1O3
9.48942
Ag1Ba1P1
2.71071
O3Tl2
0.474624
Cu4Er1Pd1
1.81324
Si3Sr5
1.99372
Ga1Sc1
8.28117
Cd1Ni4Sc1
3.97507
Au7Cd16Na6
0.145425
Hf1Tc2
1.31063
Ge2Tb1
2.36111
Ca3Ge13Ir4
1.21055