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

* xyz 1 1
 C                 -0.92337000    1.37563500    0.04722400
 N                 -0.47844100    2.54736800   -0.17730400
 O                  1.09790600    2.47272800   -0.49644600
 H                  1.17458600    2.63287000   -1.45642800
 H                  1.44770500    3.26008100   -0.03843500
 C                 -0.42786800    0.00256200    0.08659800
 C                 -1.40291600   -1.00151800    0.03405400
 C                  0.91953300   -0.37222700    0.19046700
 C                 -0.98823800   -2.33151600    0.05660900
 H                 -2.46014600   -0.76537100   -0.03149000
 C                  1.21399000   -1.73138500    0.22283600
 H                  1.72095500    0.34806200    0.27187400
 H                 -1.71729500   -3.13419400    0.00578700
 H                  2.24396300   -2.06283200    0.31410100
 N                  0.29046500   -2.69289500    0.14914000
 H                 -1.99581300    1.52210300    0.23266700
*