%chk=000129161.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129161

0 1
 O   -1.943100     -0.6762000     -0.2963000    
 O   -3.711500      -1.824900      -1.222600    
 O    1.313300       2.366700      0.3359000    
 N   0.6170000      0.1697000      0.8003000    
 N    2.057600      -1.725200      0.3346000    
 N    3.849800       1.141300     -0.6459000    
 N  -2.5800001E-02  -2.115600       1.246800    
 N    4.228200      -1.054100     -0.6371000    
 C   -1.732300      0.6586000      0.2139000    
 C  -0.6818000      0.5955000       1.319300    
 C   -3.090700       1.098200      0.7473000    
 C   -1.238500       1.542400     -0.9376000    
 C   -3.997500      0.3009000     -0.1137000    
 C   -3.254400     -0.8643000     -0.6308000    
 C    1.518200       1.156800      0.3421000    
 C   0.9203000      -1.229300      0.7786000    
 C    2.728500      0.5621000     -0.1255000    
 C   -5.265500      0.5546000     -0.4401000    
 C    2.984100     -0.7848000     -0.1304000    
 C    4.723900      0.1277000     -0.9388000    
 H  -0.9950000     -5.0299998E-02   2.144700    
 H  -0.5638000       1.595600       1.756600    
 H   -3.247200       2.178500      0.6736000    
 H   -3.233000      0.7923000       1.790400    
 H   -2.017700       1.640700      -1.704000    
 H  -0.9983000       2.555400     -0.6021000    
 H  -0.3892000       1.102900      -1.469600    
 H   -5.771700       1.431600     -5.0999999E-02
 H   -5.827900     -9.9100001E-02  -1.098100    
 H    4.008200       2.130000     -0.7894000    
 H   0.1753000      -3.110300       1.251800    
 H  -0.9685000      -1.857400       1.507600    
 H    5.697900      0.3183000      -1.366600    


%chk=000129161-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129161

0 1
O -2.344260 -0.877267 -0.129307
O -4.414026 -1.911624 -0.422037
O 1.231338 2.388777 0.420442
N 0.667559 0.080549 0.548417
N 2.289704 -1.703894 0.158162
N 4.113586 1.347144 -0.197904
N 0.052819 -2.226719 0.593714
N 4.595062 -0.887942 -0.265620
C -1.814667 0.545844 0.041997
C -0.658335 0.484933 1.065524
C -3.042068 1.311195 0.627227
C -1.391955 1.056754 -1.339054
C -4.238941 0.501549 0.169021
C -3.768945 -0.883021 -0.164956
C 1.605030 1.171924 0.327214
C 1.040156 -1.282479 0.415819
C 2.912561 0.674890 0.044715
C -5.541184 0.860689 0.060140
C 3.226056 -0.709915 -0.002226
C 5.084372 0.366512 -0.373497
H -0.941741 -0.184366 1.898564
H -0.518509 1.510518 1.452810
H -3.060715 2.357476 0.282499
H -2.992546 1.320432 1.734326
H -2.271005 1.172923 -1.997042
H -0.884010 2.031490 -1.234888
H -0.690873 0.352553 -1.816947
H -5.890408 1.870123 0.302100
H -6.283456 0.128252 -0.277328
H 4.231597 2.359364 -0.225656
H 0.374203 -3.191309 0.519916
H -0.933608 -2.011226 0.404974
H 6.126111 0.604172 -0.577217


