%chk=000170979.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170979

0 1
 O   0.5722000       1.753000       1.056000    
 C  -9.9100001E-02  0.9774000      5.5700000E-02
 C   0.2227000     -0.5230000      2.9700000E-02
 C   0.9507000       2.004200     -0.3056000    
 C    1.786600     -0.8194000      4.4300001E-02
 C   -2.390000      1.1100000E-02 -6.6799998E-02
 C   -1.567500       1.318500     -3.3500001E-02
 C  -0.4536000      -1.073500      -1.273600    
 C  -0.5349000      -1.156800       1.230700    
 C   -1.961500     -0.7827000      -1.311900    
 C   -2.040000     -0.8349000       1.177000    
 C    2.363000       1.622100     -0.5914000    
 C    2.515700      0.1433000     -0.9357000    
 C    2.417500     -0.6925000       1.454000    
 C    2.105900      -2.264100     -0.4199000    
 C   -3.887900      0.3173000     -0.1088000    
 H   0.6592000       2.952900     -0.7336000    
 H   -1.754400       1.909400     -0.9387000    
 H   -1.871100       1.933000      0.8235000    
 H  -0.3251000      -2.158800      -1.353300    
 H   6.3000000E-03 -0.6322000      -2.165300    
 H  -0.1468000     -0.7762000       2.182700    
 H  -0.3976000      -2.244200       1.245800    
 H   -2.515000      -1.728600      -1.373700    
 H   -2.202500     -0.2270000      -2.227100    
 H   -2.329100     -0.3014000       2.091700    
 H   -2.610300      -1.772500       1.175900    
 H    2.997200       1.879100      0.2653000    
 H    2.734600       2.218300      -1.433300    
 H    2.142700     -1.7200001E-02  -1.955000    
 H    3.587000     -9.4599999E-02 -0.9727000    
 H    2.211600      0.2640000       1.937300    
 H    2.060700      -1.483200       2.123300    
 H    3.508500     -0.7930000       1.401500    
 H    3.173800      -2.486700     -0.3042000    
 H    1.553500      -3.006100      0.1657000    
 H    1.872500      -2.417800      -1.478600    
 H   -4.479100     -0.6044000     -0.1445000    
 H   -4.200700      0.8806000      0.7773000    
 H   -4.144900      0.9133000     -0.9914000    


%chk=000170979-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170979

0 1
O 0.533166 1.749629 1.243938
C -0.080616 0.979818 0.075605
C 0.235679 -0.533558 0.008955
C 0.965614 2.020342 -0.188403
C 1.800353 -0.839136 0.030207
C -2.413602 0.007530 -0.076409
C -1.562136 1.301296 -0.169403
C -0.438294 -1.037767 -1.316882
C -0.533455 -1.201109 1.193955
C -1.993987 -0.896773 -1.265994
C -2.022715 -0.724970 1.237602
C 2.398445 1.638356 -0.538513
C 2.525789 0.149107 -0.936359
C 2.411251 -0.703930 1.457962
C 2.111873 -2.283444 -0.457336
C -3.919969 0.326472 -0.112605
H 0.620667 3.005835 -0.535835
H -1.700848 1.767381 -1.166228
H -1.887537 2.039320 0.588369
H -0.175295 -2.097671 -1.472632
H -0.030730 -0.478578 -2.180623
H -0.039122 -0.952724 2.147082
H -0.483708 -2.301036 1.076507
H -2.472220 -1.889183 -1.151240
H -2.375543 -0.466674 -2.212845
H -2.178077 -0.036588 2.090916
H -2.700459 -1.586975 1.392007
H 3.043943 1.869736 0.330084
H 2.750734 2.273747 -1.373936
H 2.120890 0.014598 -1.959652
H 3.597909 -0.127069 -0.987052
H 2.096599 0.229633 1.950063
H 2.116910 -1.554548 2.099523
H 3.516453 -0.716006 1.387091
H 3.177077 -2.511858 -0.263602
H 1.508519 -3.038086 0.080818
H 1.939485 -2.411608 -1.541171
H -4.521393 -0.602734 -0.122787
H -4.225221 0.915951 0.772922
H -4.185627 0.909975 -1.015298


