# train a SchNet model...
model:
    +SchNet:
        layers: 3
        channels: 64
        cutoff: =/CUTOFF

# ...using some of the QM7 structures...
data:
    +load_atoms_dataset:
        id: QM7
        cutoff: =/CUTOFF
        n_train: 5_000
        n_valid: 100

# ...training on energy labels...
loss: +PerAtomEnergyLoss()

# ...using a cutoff of 5.0 Å
#    (referenced above)
CUTOFF: 5.0