%chk=000127846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127846

0 1
 O   -1.965300       1.150900      8.9299999E-02
 O    2.728700      0.9696000      0.6161000    
 O    2.688400      -1.798200      0.3813000    
 C   -3.253800      0.5308000     -0.1112000    
 C   -3.251700     -0.9748000     -0.2356000    
 C  -0.8494000      0.3652000      0.1529000    
 C  -0.8749000      -1.025900      3.4699999E-02
 C   -3.830700       1.142000      -1.393800    
 C   -4.118000      0.9376000       1.088400    
 C   -2.140200      -1.710200     -0.1680000    
 C   0.3638000       1.030500      0.3484000    
 C   0.3225000      -1.746900      0.1135000    
 C    1.553500      0.3078000      0.4260000    
 C    1.533000      -1.080200      0.3088000    
 C    3.101000       1.927200     -0.3733000    
 C    4.611200       2.010300     -0.4354000    
 C    3.381800      -2.035700     -0.8423000    
 H   -4.203900      -1.477500     -0.3873000    
 H   -3.855400       2.236100      -1.328300    
 H   -3.201500      0.8998000      -2.258800    
 H   -4.846900      0.7867000      -1.597600    
 H   -5.147100      0.5732000      0.9961000    
 H   -3.697200      0.5471000       2.022800    
 H   -4.147500       2.028300       1.196700    
 H   -2.166800      -2.789300     -0.2604000    
 H   0.3721000       2.113400      0.4475000    
 H   0.3186000      -2.831300      2.3800001E-02
 H    2.714800       1.643400      -1.360200    
 H    2.685700       2.902700     -9.8300003E-02
 H    4.932200       2.745400      -1.178800    
 H    5.022100       2.291900      0.5398000    
 H    5.041800       1.037000     -0.6923000    
 H    3.628000      -1.093200      -1.340800    
 H    2.778100      -2.663400      -1.505300    
 H    4.311600      -2.562900     -0.6123000    


%chk=000127846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127846

0 1
O -1.957405 1.000503 -0.761226
O 2.869169 0.612163 -0.108964
O 2.557286 -2.135813 0.504857
C -3.322549 0.543957 -0.284613
C -3.428891 -0.975567 -0.339699
C -0.851183 0.209388 -0.412205
C -0.989526 -1.179001 -0.132050
C -4.297816 1.232478 -1.252635
C -3.496243 1.051372 1.167503
C -2.326800 -1.769030 -0.216191
C 0.414536 0.827791 -0.435421
C 0.186244 -1.924308 0.134716
C 1.575706 0.069366 -0.151517
C 1.460307 -1.329664 0.133461
C 3.012798 2.066655 -0.326306
C 4.496962 2.391912 -0.182773
C 3.665848 -2.232441 -0.466234
H -4.435585 -1.398206 -0.437724
H -4.141722 2.324769 -1.235600
H -4.139421 0.871168 -2.282556
H -5.341629 1.021262 -0.957838
H -4.490134 0.764750 1.557395
H -2.728775 0.607108 1.825041
H -3.404575 2.151846 1.201960
H -2.418555 -2.861596 -0.205725
H 0.462085 1.895349 -0.663382
H 0.126250 -2.996197 0.352871
H 2.638014 2.327042 -1.337305
H 2.405494 2.608049 0.427260
H 4.660359 3.476344 -0.319665
H 4.862442 2.106126 0.818149
H 5.092618 1.852003 -0.938800
H 4.142421 -1.249841 -0.620632
H 3.301122 -2.633249 -1.432716
H 4.379748 -2.939089 -0.015333


