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2 | #define __TCPROPS_H__ | |
3 | ||
4 | ||
5 | < | enum atomNames { HEAD, CH, CH2, CH3, SSD }; |
5 | > | enum atomNames { HEAD, CH, CH2, CH3, SSD, COM }; |
6 | ||
7 | struct atomCoord{ | |
8 | enum atomNames type; |
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