| #CoreShells bond BondDipoles UreyBradley bend inv tors improper-torsion bond/bond bond/bend bend/bend stretch/torsion bend/torsion | |
| 2 2 0 0 3 0 0 0 0 0 0 0 0 | |
| # Core and Shells | |
| O shO | |
| Oa shOa | |
| #bond stretch atom n1-n2, equilibrium distance, bondforce-constant | |
| O shO CORE_SHELL_SPRING 1308559.403689 | |
| Oa shOa CORE_SHELL_SPRING 3181030.436364 | |
| #bond bending atom n1-n2-n3, equilibrium angle, bondforce-constant | |
| shO Si shO CORE_SHELL_BEND 2134.8836673 109.47 | |
| shOa Si shO CORE_SHELL_BEND 2134.8836673 109.47 | |
| shOa Al shOa CORE_SHELL_BEND 7540.8928232 109.47 | |