%chk=000155723.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155723

0 1
 O   0.2166000       2.196700       1.115000    
 O   -4.845600      -1.236200     -0.3798000    
 O    4.714200      -2.550500     -0.2662000    
 O    5.262100     -0.8650000       1.152200    
 N    1.013000       1.155200     -0.7986000    
 C    3.336300      0.9115000      7.4000000E-03
 C    2.324800       1.742900     -0.7803000    
 C    3.570200     -0.4907000     -0.5607000    
 C   -1.245600      0.7259000      2.0800000E-02
 C   5.1899999E-02   1.434800      0.1658000    
 C   -2.005000      0.4907000       1.148100    
 C   -1.650300      0.3261000      -1.236000    
 C    4.606300      -1.281400      0.2075000    
 C   -3.655700     -0.5890000     -0.2471000    
 C   -3.223700     -0.1743000       1.012600    
 C   -2.869000     -0.3388000      -1.371400    
 C   -5.600600      -1.457800      0.8106000    
 H    3.005600      0.8245000       1.050300    
 H    4.290100       1.453600      3.0400001E-02
 H    2.649300       1.846800      -1.821100    
 H    2.261500       2.747400     -0.3478000    
 H    3.909400     -0.4141000      -1.599700    
 H    2.634300      -1.059700     -0.5357000    
 H   0.8392000      0.4608000      -1.516900    
 H   -1.679900      0.8028000       2.136200    
 H   -1.085500      0.5319000      -2.139000    
 H   -3.784000     -0.3371000       1.927000    
 H   -3.204600     -0.6526000      -2.356200    
 H    5.376900      -3.072300      0.2346000    
 H   -5.066700      -2.109800       1.510200    
 H   -6.516200      -1.983100      0.5194000    
 H   -5.907100     -0.5140000       1.274200    


%chk=000155723-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155723

0 1
O 0.410458 1.955211 1.235897
O -5.008826 -1.215869 -0.383611
O 4.872700 -2.525841 -0.293883
O 5.585089 -0.750351 1.021509
N 1.053563 1.127035 -0.833357
C 3.418074 0.943408 0.051095
C 2.384101 1.758127 -0.760287
C 3.694219 -0.443636 -0.557749
C -1.211250 0.624207 0.005206
C 0.126590 1.285422 0.189649
C -2.025489 0.467939 1.153137
C -1.712399 0.171237 -1.247588
C 4.800853 -1.195237 0.156588
C -3.770302 -0.598506 -0.178552
C -3.293757 -0.140722 1.077019
C -2.976400 -0.433732 -1.343012
C -5.882765 -1.395980 0.780636
H 3.052833 0.838963 1.087812
H 4.361015 1.519026 0.105603
H 2.744404 1.922043 -1.794189
H 2.255045 2.742378 -0.277278
H 3.995107 -0.357768 -1.622805
H 2.788031 -1.077763 -0.546661
H 0.840624 0.512203 -1.618335
H -1.639301 0.842190 2.107017
H -1.140670 0.318669 -2.171976
H -3.894791 -0.250507 1.984378
H -3.376585 -0.775803 -2.302003
H 5.617134 -2.989125 0.178459
H -5.408239 -2.044781 1.541748
H -6.785697 -1.884458 0.386789
H -6.151169 -0.422778 1.234543


