votca::xtp::Atom::data Struct Reference

#include <atom.h>

Public Attributes
Index	id
char *	element
char *	name
double	x
double	y
double	z
Index	resnr

Detailed Description

Definition at line 37 of file atom.h.

Member Data Documentation

element

char* votca::xtp::Atom::data::element

Definition at line 39 of file atom.h.

id

Index votca::xtp::Atom::data::id

Definition at line 38 of file atom.h.

name

char* votca::xtp::Atom::data::name

Definition at line 40 of file atom.h.

resnr

Index votca::xtp::Atom::data::resnr

Definition at line 44 of file atom.h.

x

double votca::xtp::Atom::data::x

Definition at line 41 of file atom.h.

y

double votca::xtp::Atom::data::y

Definition at line 42 of file atom.h.

z

double votca::xtp::Atom::data::z

Definition at line 43 of file atom.h.

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The documentation for this struct was generated from the following file:

• xtp/include/votca/xtp/atom.h