%chk=000154318.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154318

0 1
 O    1.063400       1.004300       1.733900    
 O   0.3733000      -1.477600     -4.3499999E-02
 O    1.779800     -0.2826000       1.580200    
 O   0.8340000       1.837900      -1.820000    
 O    3.041100      -1.799600     -0.7045000    
 C   0.5729000      0.9328000      0.3754000    
 C    1.333800     -0.4007000      0.2096000    
 C  -0.8814000      0.4652000      0.1843000    
 C   0.9745000       2.131200     -0.4336000    
 C    2.502900     -0.4827000     -0.7328000    
 C  -0.9012000     -0.9234000     -5.1199999E-02
 C   -2.090400       1.146700      0.2060000    
 C   -2.059200      -1.645800     -0.2620000    
 C   -3.280000      0.4395000     -4.9000001E-03
 C   -3.263500     -0.9454000     -0.2371000    
 H    2.019700       2.404800     -0.2525000    
 H   0.3561000       3.003400     -0.1963000    
 H    3.300600      0.2171000     -0.4646000    
 H    2.208100     -0.2819000      -1.766700    
 H   -2.118800       2.216700      0.3859000    
 H   -2.037900      -2.714600     -0.4398000    
 H   -4.229300      0.9684000      1.1500000E-02
 H    1.105700       2.633600      -2.308300    
 H   -4.199300      -1.473600     -0.3980000    
 H    2.336400      -2.408300     -0.9852000    


%chk=000154318-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154318

0 1
O 0.922550 0.996984 1.780837
O 0.428352 -1.489695 -0.073993
O 1.813726 -0.293664 1.577520
O 0.829547 2.038739 -1.822805
O 3.089384 -1.920049 -0.730677
C 0.537394 0.931340 0.286470
C 1.384113 -0.373989 0.150994
C -0.878083 0.470839 0.096043
C 1.001346 2.220975 -0.376193
C 2.539843 -0.569633 -0.823497
C -0.877219 -0.936959 -0.046329
C -2.094632 1.174660 0.083903
C -2.051727 -1.686701 -0.188365
C -3.299735 0.444041 -0.058193
C -3.273012 -0.967298 -0.188846
H 2.061566 2.404520 -0.110813
H 0.391094 3.063921 0.012413
H 3.369028 0.108171 -0.566707
H 2.175299 -0.335855 -1.844216
H -2.115196 2.264825 0.189354
H -2.022683 -2.774263 -0.294351
H -4.259381 0.970547 -0.065238
H 0.946986 2.903285 -2.288605
H -4.214408 -1.517192 -0.295645
H 2.337148 -2.562152 -0.817261


