| # | Line 353 | Line 353 | namespace OpenBabel | |
|---|---|---|
| 353 | } | |
| 354 | os << " atom[" << ai << "] { "; | |
| 355 | os << "type = " << "\"" << str1 << "\"" << "; "; | |
| 356 | + | os << "position( " << atom->GetX() << ", " << atom->GetY() << ", " << atom->GetZ() << ");"; |
| 357 | os << "}\n"; | |
| 358 | atomMap[&(*atom)] = ai++; | |
| 359 | } | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |