错误如下：
(Enter /opt/apps/chemistry/Gaussian/g16/l1002.exe)
Minotr: Closed shell wavefunction.
IDoAtm=11111111111111111111111111111111111111111111111111
IDoAtm=11111111111111111111111111111111111111111111
NEqPCM: Using equilibrium solvation (IEInf=0, Eps= 35.6880, EpsInf= 1.8069)
Direct CPHF calculation.
Differentiating once with respect to electric field.
with respect to dipole field.
Differentiating once with respect to nuclear coordinates.
Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
28979 words used for storage of precomputed grid.
Two-electron integrals replicated using symmetry.
MDV= 104857600 using IRadAn= 1.
Solving linear equations simultaneously, MaxMat= 72.
AlAXAO: NMat= 285 NPMax= 20 NPMax1= 0 MaxMat= 72 Max3X=T NPAlg=2.
104806918 words are not enough for AlAXAO.
Error termination via Lnk1e in /opt/apps/chemistry/Gaussian/g16/l1002.exe at Mon Mar 26 20:29:27 2018.
Job cpu time: 0 days 13 hours 19 minutes 2.8 seconds.
Elapsed time: 0 days 0 hours 46 minutes 49.3 seconds.
File lengths (MBytes): RWF= 3106 Int= 0 D2E= 0 Chk= 83 Scr= 1
