%chk=000112457.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112457

0 1
 O  -0.5741000      0.8567000     -0.5268000    
 O   -1.768300     -0.8883000      0.6353000    
 C   0.5590000      -1.243000     -3.5399999E-02
 C   0.5513000      0.3014000      0.1627000    
 C    1.798400       1.030000     -0.3272000    
 C  -0.8987000      -1.767000     -7.5300001E-02
 C   -1.819200      0.4173000      3.8899999E-02
 C    1.307400      -1.890300       1.146300    
 C    1.249700      -1.683800      -1.339700    
 C    1.659700       2.535400     -0.1123000    
 C    3.043200      0.4990000      0.3803000    
 C   -2.245500       1.398600       1.133500    
 C   -2.862600      0.4339000      -1.080300    
 H   0.4288000      0.5315000       1.230100    
 H    1.918300      0.8947000      -1.409200    
 H   -1.265200      -1.871400      -1.103300    
 H  -0.9835000      -2.759500      0.3803000    
 H    2.391300      -1.796200       1.112200    
 H   0.9556000      -1.498400       2.107200    
 H    1.121500      -2.972000       1.163500    
 H    1.114200      -2.761300      -1.496200    
 H   0.8088000      -1.175200      -2.204800    
 H    2.325200      -1.507800      -1.363400    
 H   0.8155000       2.948400     -0.6740000    
 H    2.559200       3.061000     -0.4513000    
 H    1.512200       2.773900      0.9468000    
 H    3.412000     -0.4432000     -2.1800000E-02
 H    3.874800       1.201000      0.2382000    
 H    2.895700      0.4158000       1.462100    
 H   -2.272400       2.427100      0.7580000    
 H   -3.228700       1.137300       1.539500    
 H   -1.543100       1.380000       1.973800    
 H   -2.555800     -0.2056000      -1.914900    
 H   -3.831600      6.5600000E-02 -0.7274000    
 H   -2.987800       1.442100      -1.490200    


%chk=000112457-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112457

0 1
O -0.574867 0.781352 -0.598519
O -1.780368 -0.911050 0.617219
C 0.605451 -1.332634 -0.042694
C 0.599460 0.235102 0.142969
C 1.822115 1.045094 -0.357336
C -0.893185 -1.759937 -0.196632
C -1.863610 0.456939 0.046103
C 1.184470 -2.015605 1.223431
C 1.341135 -1.798586 -1.322457
C 1.570492 2.562459 -0.173061
C 3.138077 0.653820 0.360677
C -2.171860 1.382015 1.230526
C -2.912454 0.534065 -1.070662
H 0.461302 0.445253 1.226972
H 1.936386 0.846378 -1.441705
H -1.194928 -1.716325 -1.262371
H -1.051055 -2.784515 0.181516
H 2.205773 -1.670317 1.456991
H 0.541578 -1.804147 2.098568
H 1.222221 -3.113392 1.087119
H 1.151604 -2.875112 -1.499628
H 0.981422 -1.241731 -2.207367
H 2.434607 -1.665629 -1.251173
H 0.645790 2.873088 -0.684648
H 2.417477 3.145581 -0.580294
H 1.472904 2.815171 0.901395
H 3.448586 -0.385464 0.159898
H 3.955982 1.316514 0.022488
H 3.041871 0.777271 1.456826
H -2.315287 2.416646 0.875811
H -3.091155 1.043602 1.738396
H -1.349798 1.365673 1.965718
H -2.698711 -0.209058 -1.857685
H -3.916799 0.339000 -0.658525
H -2.899324 1.536181 -1.532665


