%nproc=12
%mem=20GB
%chk=DIPEA_HBr.chk
#p opt b3lyp/gen freq pseudo=read EmpiricalDispersion=GD3BJ scrf=(pcm,solvent=chlorobenzene) pop=(orbitals=20) optcyc=300 nosymm

Title Card Required

0 1
 N                  4.61598900   -1.37175500    0.05252000
 C                  4.59183700   -0.65357000    1.34219100
 H                  4.55548100   -1.42933400    2.11961100
 C                  5.64592000   -2.42072800   -0.07477300
 H                  6.64552900   -1.96301900   -0.26302400
 C                  4.56858000   -0.48033600   -1.11914700
 H                  4.64396400    0.57139200   -0.79935400
 H                  5.45365300   -0.64855700   -1.75854100
 C                  3.29277600   -0.65012900   -1.94533200
 H                  3.29558500    0.02701300   -2.81686500
 H                  3.19004500   -1.68302300   -2.31147100
 H                  2.40348500   -0.42289700   -1.33680400
 C                  5.76447700   -3.28762800    1.18230200
 H                  6.43488100   -4.13607300    0.97682300
 H                  6.17923400   -2.74445600    2.04291300
 H                  4.77927000   -3.69300900    1.46741500
 C                  5.32689300   -3.33049800   -1.26847900
 H                  4.35534400   -3.82830000   -1.11400500
 H                  5.27935600   -2.77897000   -2.21786900
 H                  6.10473300   -4.10320800   -1.37404500
 C                  3.29780400    0.15139700    1.49315300
 H                  3.24842700    0.99999000    0.79211700
 H                  2.42349200   -0.49247500    1.31314200
 H                  3.22628500    0.56333400    2.51227600
 C                  5.83075800    0.21619200    1.61707800
 H                  5.77976000    0.65240100    2.62799000
 H                  6.75866800   -0.37375700    1.55277000
 H                  5.91197600    1.04989500    0.90043600
 H                  3.74834135   -1.86837094    0.02885213
 Br                 7.04586640   -0.01360383    0.20764968

-C H N Br 0
cc-pVDZ
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