formula
stringlengths
2
15
target
float64
43.9
2.11k
Ni2Sn1Yb1
207.263
Cd1Yb1
170.096
Cd2La1Pd1
206.021
B4H16Hf1
268.025
Au1La2
128.544
O4Si1Zn2
609.407
Cr1O4Tb1
441.3
Ba1Cu2S2
277.085
Au1Er1In1
211.385
Al1Lu3N1
380.722
Al1Os1
399.56
Bi5La3Sc1
176.425
B1Rh3Sc1
454.591
Nb1S4Tl3
113.416
H15Th4
315.58
Cu1Ti3
369.69
Nb1O3Sr1
506.163
Ca1O3Ru1
539.817
Li21Si5
604.871
La2S3
287.783
F4Ni1Rb2
283.947
Al1Cu1Er1
291.908
Rh1Sb1U1
188.572
Al1Dy1Ni1
264.307
Ni1Sn1U1
188.684
Br1K3O1
241.795
Ge13Ru4Y3
331.824
H3Y1
580.43
C2Na1
957.181
Cl6Pd1Rb2
157.893
B1La1Pt2
211.942
B2Li2Rh3
483.218
Hg1Se1
136.373
Mn1S4Sc2
347.133
Li1Pb1
129.234
Cu1Sn1Y1
317.371
Ni1P1Pd1
281.352
B12Th1
976.339
Ca1F6Sn1
343.353
Ca1Ir1Sn2
233.366
Li3O4U1
481.288
Al1C1Co3
519.402
Al3Li1
552.733
Cu3N1Pd0.25
312.378
Dy1Ge1Ir1
229.791
Cl1Na3O1
403.805
Cd1Tb1
181.515
Hf1O1S1
351.725
Mg1O4Rh2
454.08
Si2Th3
253.293
Be13Ho1
909.446
Au1Er1Ni4
330.351
Bi3Tb4
171.745
Ga2Zr3
374.13
Mo1P1Rh1
453.25
Ga1S8Ti4
372.934
Cu3Se2
206.425
Cd1Sc1
254.421
Nb1P1Ru1
495.407
Gd1O4P1
439.149
Mo1N1
325.232
Au1Mn2
207.345
Co1Er1Ga1
232.827
Ir3Sc1
353.749
Cl1Cs1
140.162
Sb4Ta5
205.594
S1Tb1
284.327
Er2Mg1Se4
201.528
Na8Sb4Sn1
173.79
Al1Co2Nb1
476.419
H3K1Mg1
605.759
In2Mg1O4
449.344
Ir3Mg3Si8
338.912
Ba1O3Tb1
336.293
Ag1Ga1Te2
173.588
Ge13Ir4Tb3
314.81
Er1Tl1
155.907
Bi1Er2O2
227.798
Ge13Ho3Rh4
335.625
Pd2Sn1Tb1
160.516
Er1Ga2Pd1
278.501
Ag1P1Pt5
211.092
Ag1Te1Tl1
119.788
Al9Ba1Ni2
440.043
Cl6Cs2Sn1
107.197
B2Hf1
710.983
Ir3Si1
352.722
Re1Ti1
248.827
Au1Ba1
131.592
Rh1Sb2
295.27
Cu1Ga1Te2
216.858
Au1Sn1Y1
234.478
Pt1Se1Si1
342.15
Al1La1O3
660.805
B1In1Sc3
432.205
La1Sn3
163.671
Hf2La2O7
454.664
Er3F10K1
376.262
Ba1Ga4
260.277
Cu1F3K1
362.484