%chk=000076549.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076549

0 1
 O  -0.2317000     -0.9114000       1.433500    
 O   -2.151500       1.266400      0.6896000    
 O    1.806900       1.428000     -0.3411000    
 O    3.839700      0.5798000      0.2029000    
 N   0.6680000     -0.8944000     -0.7064000    
 C   -1.734700     -0.8242000     -0.4380000    
 C  -0.3680000     -0.8784000      0.2119000    
 C    2.057000     -0.9532000     -0.3133000    
 C   -2.578600      0.3656000     -3.0700000E-02
 C   -3.977900      0.4121000     -0.5866000    
 C    2.670900      0.4097000     -0.1217000    
 H   -1.646700     -0.8110000      -1.529500    
 H   -2.264900      -1.739300     -0.1516000    
 H    2.597300      -1.470200      -1.111200    
 H    2.144400      -1.509800      0.6245000    
 H   0.4626000     -0.8443000      -1.699700    
 H   -4.498800       1.293300     -0.2018000    
 H   -3.936900      0.4716000      -1.676900    
 H   -4.525000     -0.4820000     -0.2774000    
 H    2.229500       2.303300     -0.2092000    


%chk=000076549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076549

0 1
O -0.148160 -2.639689 0.050198
O -1.633728 1.326785 -0.617990
O 2.078946 1.656009 -0.457002
O 3.982850 0.524571 0.254059
N 0.470894 -0.424356 -0.283086
C -1.870699 -1.108512 -0.759939
C -0.442613 -1.448492 -0.281793
C 1.851084 -0.685435 0.121346
C -2.394927 0.317601 -0.575593
C -3.889725 0.462910 -0.353053
C 2.763350 0.520086 -0.009585
H -1.904633 -1.326144 -1.849332
H -2.550426 -1.837750 -0.287712
H 2.282335 -1.511761 -0.476255
H 1.904351 -1.035343 1.172061
H 0.159798 0.534140 -0.506716
H -4.189871 1.518639 -0.435017
H -4.459783 -0.151168 -1.074511
H -4.150372 0.091479 0.657350
H 2.702929 2.428030 -0.520132


