Configuration Set

ANI-2x-B973c-def2mTZVP_num_atoms_29__CS_x4ihx4v7vxp5_0



Name ANI-2x-B973c-def2mTZVP_num_atoms_29
Extended ID ANI-2x-B973c-def2mTZVP_num_atoms_29__CS_x4ihx4v7vxp5_0
Description Configurations with 29 atoms from ANI-2x-B973c-def2mTZVP dataset
Elements C (32.24%)
Cl (0.08%)
F (0.09%)
H (55.38%)
N (5.86%)
O (5.79%)
S (0.57%)
Number of Configurations 39,595
Number of Atoms 1,148,255
Configurations