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/dports/science/bagel/bagel-1.2.2/src/molecule/
H A Dshellpair.h67 const std::pair<int, int>& shell_ind() const { return shell_ind_; } in shell_ind() function
68 …int shell_ind(const int i) const { assert(i==0 || i==1); return (i == 0) ? shell_ind_.first : shel… in shell_ind() function