%chk=000081786.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081786

0 1
 O    1.878300      -1.299900      3.1999999E-03
 O    4.232900     -3.1700000E-02  5.4000001E-03
 N   0.7286000      0.7503000     -1.6000000E-03
 N    3.030600      0.6892000     -3.7000000E-03
 C  -0.6144000      0.3719000     -1.1000000E-03
 C   -1.613100       1.345600      1.6000000E-03
 C  -0.9583000     -0.9799000     -2.3000001E-03
 C   -2.955800      0.9675000      2.7000001E-03
 C   -2.301000      -1.358000     -1.2000001E-03
 C   -3.299800     -0.3843000      1.2000001E-03
 C    1.872100     -7.0799999E-02 -4.1000000E-03
 H   -1.359700       2.402700      2.9000000E-03
 H  -0.2435000      -1.790600     -4.9000001E-03
 H   0.9053000       1.752000     -1.1000000E-03
 H   -3.733600       1.725500      4.6000001E-03
 H   -2.570200      -2.410300     -2.4999999E-03
 H   -4.345200     -0.6787000      1.9000000E-03
 H    3.085600       1.682400     -0.1955000    
 H    4.425000     -3.2499999E-02  0.9584000    


%chk=000081786-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081786

0 1
O 2.012955 -1.139018 0.311886
O 4.312296 0.117750 0.137080
N 0.738892 0.869900 0.125707
N 3.088290 0.901492 0.171008
C -0.599215 0.381371 0.061819
C -1.638637 1.347757 -0.011540
C -0.919283 -1.002075 0.069143
C -2.985172 0.937185 -0.078511
C -2.273291 -1.394464 -0.002707
C -3.312496 -0.438781 -0.076216
C 1.912794 0.127597 0.186472
H -1.393796 2.418290 -0.017246
H -0.117529 -1.739701 0.138614
H 0.834141 1.886337 0.187987
H -3.776785 1.692525 -0.133457
H -2.514832 -2.463303 0.003526
H -4.358306 -0.758766 -0.128794
H 3.205367 1.728988 -0.420396
H 3.948407 -0.822682 0.239526


