| SimulationType MonteCarlo | |
| NumberOfCycles 1000000 | |
| NumberOfInitializationCycles 10000 | |
| PrintEvery 50000 | |
| RestartFile no | |
| Forcefield ExampleMoleculeForceField | |
| Box 0 | |
| BoxLengths 25 25 25 | |
| ExternalTemperature 298.0 | |
| ExternalPressure 0.0 | |
| ComputeMoleculeProperties yes | |
| component 0 MoleculeName 2-methylbutane | |
| FugacityCoefficient 1.0 | |
| MoleculeDefinition ExampleDefinitions | |
| TranslationProbability 1.0 | |
| RotationProbability 1.0 | |
| ReinsertionProbability 1.0 | |
| PartialReinsertionProbability 1.0 | |
| CreateNumberOfMolecules 32 | |