%chk=000157474.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157474

0 1
 O    1.013100      -2.519200      0.6202000    
 O    3.334500       1.521200      0.3724000    
 O    3.121300      -2.469600      -1.460800    
 O   -4.907300     -0.6525000     -0.2269000    
 O   -3.823700      -2.537000      0.1080000    
 N    2.232800     -0.5380000      0.4405000    
 N   -3.844600      -1.292400     -4.3400001E-02
 C  -0.1838000      0.8308000      6.6799998E-02
 C  -0.2100000     -0.5610000      0.2317000    
 C    1.012700       1.560700      0.1007000    
 C   -1.404600       1.521500     -0.1379000    
 C    1.051900      -1.302900      0.4460000    
 C    2.299400      0.8611000      0.3131000    
 C    3.494900      -1.257000      0.5786000    
 C   -1.421200      -1.263600      0.1958000    
 C   -2.609600      0.8034000     -0.1722000    
 C    1.007200       2.951500     -6.4700000E-02
 C   -2.616500     -0.5798000     -6.3000000E-03
 C   -1.393200       2.914700     -0.3028000    
 C  -0.1947000       3.623800     -0.2661000    
 C    4.041500      -1.615600     -0.7926000    
 H    3.332300      -2.168400       1.164600    
 H    4.220600     -0.6373000       1.116200    
 H   -1.415200      -2.343100      0.3256000    
 H   -3.537200       1.351400     -0.3308000    
 H    1.927800       3.528400     -4.1000001E-02
 H   -2.319900       3.462400     -0.4612000    
 H  -0.1985000       4.702300     -0.3948000    
 H    4.989500      -2.152500     -0.6927000    
 H    4.212300     -0.7305000      -1.414200    
 H    2.355800      -1.928600      -1.718200    


%chk=000157474-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157474

0 1
O 1.172760 -2.457139 0.075809
O 3.381999 1.657652 0.292320
O 3.655624 -3.322785 -0.806025
O -4.995777 -0.661144 -0.239871
O -3.787180 -2.594544 -0.146842
N 2.271043 -0.405746 0.233090
N -3.882541 -1.309828 -0.165855
C -0.236786 0.958135 0.039759
C -0.201641 -0.473925 0.048172
C 0.973198 1.713528 0.109915
C -1.504386 1.644969 -0.045971
C 1.101464 -1.188930 0.119057
C 2.289912 1.026574 0.214858
C 3.581501 -1.112154 0.389872
C -1.385910 -1.215928 -0.020454
C -2.704012 0.874550 -0.113010
C 0.928010 3.117080 0.091505
C -2.622030 -0.520546 -0.097256
C -1.517482 3.078743 -0.061478
C -0.319868 3.799241 0.004966
C 4.037511 -1.918307 -0.855159
H 3.506111 -1.802804 1.248855
H 4.308864 -0.318277 0.619747
H -1.357616 -2.308963 -0.016341
H -3.684725 1.355759 -0.177208
H 1.872207 3.668533 0.147794
H -2.478041 3.601764 -0.126679
H -0.336069 4.893166 -0.008060
H 5.140295 -1.919739 -0.889173
H 3.666424 -1.416412 -1.775916
H 2.694741 -3.358320 -0.536820


