char atomnm[6]; /* True atom name including spaces */
real occup; /* Occupancy */
real bfac; /* B-factor */
- bool bAnisotropic; /* (an)isotropic switch */
+ gmx_bool bAnisotropic; /* (an)isotropic switch */
int uij[6]; /* Anisotropic B-factor */
} t_pdbinfo;