#
#Single point
#
! wB97X-D3 def2-TZVPPD autoaux TightSCF
%pal nprocs 4
end
%maxcore 4000

* xyz 1 1
 C                 -0.02399800   -0.61049900    0.00000000
 N                 -0.05833300    0.52587000    0.00000000
 H                  0.00945900   -1.69383900    0.00000000
 H                 -0.08853200    1.54062000    0.00000000
*