Configuration Set

ANI-2x-B973c-def2mTZVP_num_atoms_6__CS_k6lbzijpfr61_0




Name ANI-2x-B973c-def2mTZVP_num_atoms_6
Extended ID ANI-2x-B973c-def2mTZVP_num_atoms_6__CS_k6lbzijpfr61_0
Description Configurations with 6 atoms from ANI-2x-B973c-def2mTZVP dataset
Elements C (13.3%)
Cl (3.05%)
F (3.48%)
H (48.59%)
N (5.37%)
O (22.39%)
S (3.82%)
Number of Configurations 125,314
Number of Atoms 751,884
Configurations