structure to save center data
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#include <WFreader.h>
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std::string * | element |
| | The atomic element, using a string for easing the use.
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unsigned int | value |
| | to doc and rename
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unsigned int | rank |
| | to doc
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double | coordinates [3] |
| | coordinates to doc and rename
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double | charge |
| | to doc
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structure to save center data
The documentation for this struct was generated from the following file: