Configuration
CO_8612510102676561745454190
| Names | ANI-2x-wB97MV-def2TZVPP__natoms_035__ix_4914, ANI-2x-wB97MD3BJ-def2TZVPP__natoms_035__ix_4914, ANI-2x-B973c-def2mTZVP__natoms_035__ix_4913 |
|---|---|
| Chemical Formula Hill | C12H22O |
| Configuration Sets |
CS_6ak67twdbugf_0 CS_x2zxqjtonovp_0 CS_5qlbkl0hsdwm_0 |
| Property Objects |
PO_1221023171815663911684444 PO_9141676573443973034691198 PO_1194178902496056515244871 |
| ColabFit ID | CO_8612510102676561745454190 |
| Files | colabfitspec.json |
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