%chk=000141804.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141804

0 1
 O    1.471800      0.8185000       2.221700    
 C   0.5588000       2.159500      0.2761000    
 C    1.148800      0.8124000      0.8119000    
 C  -0.1919000      0.2143000      0.5049000    
 C  -0.7097000       1.396800      3.4299999E-02
 C  -0.9319000     -0.9440000      0.5415000    
 C    1.164000       2.687000      -1.006500    
 C   0.3741000       3.276700       1.279400    
 C    2.266700      0.1267000       0.000000    
 C   -2.000300       1.495900     -0.4294000    
 C   -2.778700      0.3358000     -0.4052000    
 C  -0.3550000      -2.214400       1.051100    
 C   -2.247900     -0.8764000      7.7100001E-02
 C   -4.187200      0.3779000     -0.8970000    
 C    1.993100     -0.4149000      -1.260700    
 C    3.563800      4.0399998E-02  0.5178000    
 C  -0.3019000      -3.317900     -2.5800001E-02
 C   -1.092000      -2.744400       2.298400    
 C   -5.205900      4.1299999E-02  0.2079000    
 C   -4.412800     -0.5391000      -2.113600    
 C    3.004200      -1.035100      -1.994700    
 C    4.574900     -0.5797000     -0.2164000    
 C    4.295100      -1.117400      -1.472700    
 H   0.6487000       3.597900      -1.337000    
 H    2.217800       2.953300     -0.8650000    
 H    1.098500       1.992800      -1.848900    
 H  -0.1262000       2.937800       2.194400    
 H    1.341700       3.698000       1.574800    
 H  -0.2293000       4.094400      0.8675000    
 H   -2.385000       2.440600     -0.7961000    
 H   0.6826000      -2.036300       1.361700    
 H   -2.867200      -1.770000      8.8100001E-02
 H    1.499400     -0.1157000       2.491200    
 H   -4.415200       1.399500      -1.230300    
 H    1.007200     -0.3696000      -1.713400    
 H    3.812400      0.4602000       1.488400    
 H   0.2151000      -4.203900      0.3580000    
 H   -1.304600      -3.626200     -0.3413000    
 H   0.2366000      -2.972800     -0.9147000    
 H   -1.114300      -1.984400       3.087400    
 H   -2.126700      -3.024000       2.072300    
 H  -0.5850000      -3.629700       2.697300    
 H   -5.109800     -0.9936000      0.5536000    
 H   -6.229000      0.1757000     -0.1600000    
 H   -5.071100      0.6982000       1.074400    
 H   -3.707100     -0.3001000      -2.916900    
 H   -5.426800     -0.4107000      -2.507700    
 H   -4.286000      -1.596900      -1.859700    
 H    2.787200      -1.452600      -2.973600    
 H    5.580700     -0.6416000      0.1887000    
 H    5.082500      -1.599300      -2.044700    


%chk=000141804-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141804

0 1
O 1.477215 0.716360 2.187809
C 0.579469 2.116274 0.264514
C 1.171131 0.656480 0.742224
C -0.228140 0.101995 0.409151
C -0.733537 1.348510 -0.008831
C -1.006419 -1.071640 0.434403
C 1.249252 2.722294 -0.984131
C 0.490768 3.150650 1.403186
C 2.370236 0.106959 -0.021442
C -2.051918 1.508484 -0.455942
C -2.874976 0.343989 -0.456688
C -0.469496 -2.407802 0.951742
C -2.347644 -0.903026 -0.012904
C -4.330554 0.439739 -0.930743
C 2.215289 -0.744287 -1.144875
C 3.683006 0.474054 0.379983
C -0.753193 -3.586329 -0.013576
C -1.030734 -2.706403 2.370250
C -5.332484 0.088562 0.201662
C -4.586792 -0.438576 -2.184866
C 3.343375 -1.219993 -1.850606
C 4.810643 -0.000727 -0.324207
C 4.645689 -0.850931 -1.443242
H 0.658179 3.585957 -1.342711
H 2.269573 3.079317 -0.751263
H 1.324738 1.991419 -1.807837
H 0.016464 2.721265 2.299200
H 1.498321 3.502289 1.690062
H -0.099893 4.024774 1.067451
H -2.458915 2.471042 -0.787838
H 0.631784 -2.310555 1.039359
H -3.012519 -1.776437 -0.019555
H 1.802250 -0.178142 2.467712
H -4.515303 1.493982 -1.220977
H 1.207050 -1.029195 -1.467089
H 3.807163 1.130938 1.247676
H -0.299246 -4.518184 0.371341
H -1.838742 -3.764982 -0.124320
H -0.337914 -3.390181 -1.018875
H -0.811273 -1.878344 3.068414
H -2.128718 -2.834928 2.336836
H -0.590338 -3.635525 2.778421
H -5.216292 -0.962695 0.524938
H -6.374180 0.221320 -0.145993
H -5.176581 0.732439 1.085863
H -3.902656 -0.166920 -3.008867
H -5.626703 -0.314280 -2.540761
H -4.433300 -1.509974 -1.957610
H 3.206400 -1.878788 -2.715825
H 5.816959 0.291685 -0.002593
H 5.520706 -1.221033 -1.989432


