NSiteTypes    = 2

SiteType      = LJ126
NSites        = 2

x             = 7.660331e-01
y             = 1.338147e-02
z             = 0.0
sigma         = 3.754348
epsilon       = 120.591759
mass          = 15.034

x             = -6.564695e-01
y             = -6.389332e-02
z             = 0.0
sigma         = 3.030
epsilon       = 87.879094
mass          = 16.0

SiteType      = Charge
NSites        = 3

x             = 7.660331e-01
y             = 1.338147e-02
z             = 0.0
charge        = 0.247461
mass          = 0.0
shielding     = 0.1

x             = -6.564695e-01
y             = -6.389332e-02
z             = 0.0
charge        = -0.678742
mass          = 0.0
shielding     = 0.1

x             = -1.004989e+00
y             = 8.145993e-01
z             = 0.0
charge        = 0.431281
mass          = 1.008
shielding     = 0.05

NRotAxes      = auto