formula
stringlengths
2
15
target
float64
0.01
205
Br1Na1
1.3346
Ge3Pu1
3.54769
Al1Au1Dy1
1.97041
Be1H3Na1
10.7579
Al16Hf6Pt7
3.1633
F3Pb1Rb1
1.07497
Cl4Cu1Rb2
0.561956
Ir2La1Si2
4.67868
Mg1O6Sb2
5.37528
Bi2Pt1
0.67946
Ru1Si2
6.18898
Hf1In1Ni2
5.06755
B1In1Sc3
11.883
Au1Cd1Yb1
0.448128
B2Pd5
1.80894
In1La1Pt4
1.89401
Ho5Ni2Sb1
0.971491
Ba1Os4Sb12
2.2938
C1Pu1Rh3
0.544656
Si136
2.55111
Br3Cs1Dy1
0.316612
C2Y1
12.9193
Er1Pt1
1.95345
Be2W1
18.0692
As2Mg3
3.33101
F4Sn1
11.3856
Br1K1
0.843406
Er2In1Pd2
1.94085
Cu1Si1Y1
8.86952
Er1Pt1Sn1
2.92122
Er3P6Pd20
0.64606
Cu1Ga2
2.6483
Cu2Hf1In1
4.77311
Co4Ge13Lu3
1.69309
Ba8Si46
0.681803
Al3C3Ho1
16.161
Al2S4Sr1
3.83887
La1Sn2
2.25092
Cd2Ge2Sr1
0.614525
Cs2F6Ge1
0.821265
B2C2Sc1
23.7205
Ba1O3Sn1
7.688
N1
32.6661
Co1Ge1Ta1
16.4019
Pd1Zr2
8.32751
Pb3Tb1
0.468345
La3Tl1
0.817017
As1Pt5Tl1
2.12786
As1Sn1
5.89945
N2S1Zr2
8.86859
Au2Bi1
0.84422
B6Ni20Ta3
2.80742
Rh1V1
12.4472
Ba1O3Ti1
4.05023
Ba3Bi1N1
0.933655
Ir2N1Zr4
2.9684
Hf5P7Pd9
1.95839
F5Mn1Rb2
1.61991
Ga1Tb1
6.53973
Er3Ge13Ir4
1.73979
B6Hf3Ni20
2.37279
Al3Sc1
13.6326
Ca1In2O4
2.30697
Mo3Pt1
5.3336
Cd1I2
0.625531
F3Na1V1
2.63938
Be5Pd1
23.6466
Au1O2Sc1
2.75783
Bi1Ga1O3
10.1276
Al1N3V4
11.762
C1Ge1V2
15.6237
B1Co1W1
15.9685
Al3C3Tb1
15.871
Au1Dy1
3.80521
Pt1Sb1Tb1
5.65563
Mo3Os1
9.29637
In1Pt1Th1
2.16296
C1Ga1Y3
14.6446
O7Pb2Sb2
4.28717
B2V1
93.6017
In2Ir1Li1
3.0294
B6Yb1
14.9926
Dy2O1S2
2.56402
Cu4Mg1Y1
3.29596
Cl2O1Pd2
1.01977
Au1Ho1In1
1.79303
Ca1Ga2P2
4.80333
O1Ta4
7.12301
Ga2Sc1
4.56328
Cr2Cu1Se4
0.891784
B6Pu1
20.6604
Ca3N3V1
6.7652
Pd2Si2Th1
6.85966
In1P1Pd5
2.42942
Bi1Er2O2
5.75289
Ga1La3
1.53473
Rh3Ti1
16.8462
O1Sn1Sr3
4.58204
Ag1Ho1Se2
1.25585
La2S3
2.1284