Configuration Set

ANI-2x-wB97X-631Gd_num_atoms_6__CS_v1vxn7l2q9eg_0




Name ANI-2x-wB97X-631Gd_num_atoms_6
Extended ID ANI-2x-wB97X-631Gd_num_atoms_6__CS_v1vxn7l2q9eg_0
Description Configurations with 6 atoms from ANI-2x-wB97X-631Gd dataset
Elements C (13.28%)
Cl (3.03%)
F (3.45%)
H (48.5%)
N (5.39%)
O (22.5%)
S (3.85%)
Number of Configurations 126,215
Number of Atoms 757,290
Configurations