1. Department of Chemistry, Haverford College, 370 Lancaster Avenue, Haverford, Pennsylvania 19041, United States
2. Department of Chemistry, Fordham University, 441 East Fordham Road, The Bronx, New York 10458, United States
3. Department of Computer and Information Science, Fordham University, 441 East Fordham Road, The Bronx, New York 10458, United States
4. Molecular Foundry, Lawrence Berkeley National Laboratory, 1 Cyclotron Road, Berkeley, California 94720, United States