AUX file corruption & crashes for large MOZYME calculations

[godotalgorithm]

Describe the bug MOPAC is crashing and AO_CHARGES in the AUX file contain some invalid (all asterisk) entries when large MOZYME calculations are run with AUX output requested.

To Reproduce An example input file (reported by Dr. Joseph Leonard of CCG) that produces this problem is: mozyme-aux-bug.tar.gz

Expected behavior While a bit on the large side, this example should produce the same AUX file when run with both MOZYME and MOPAC solvers.

MOPAC executable

• [x] Using pre-built executable
• [x] Compiled my own executable

Operating system

• [ ] Linux
• [x] Mac
• [ ] Windows
• [ ] Other (specify below)