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74e10df | 1 2 3 4 5 6 7 8 9 10 11 12 13 | #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
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