%chk=000159019.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159019

0 1
 O  -0.9500000       2.244900     -0.7103000    
 O   -3.658500       2.119300     -0.3688000    
 O    3.563900       2.222500       1.176400    
 N  -0.4261000      -3.364000      5.1500000E-02
 C   0.7444000      -3.197700     -0.8316000    
 C   0.7962000      -1.879100      -1.617300    
 C  -0.4961000      -2.365000       1.129600    
 C  -0.6739000      2.1600001E-02  0.1910000    
 C   -1.286500      -1.135800      0.7207000    
 C    1.485600     -0.7638000     -0.8607000    
 C   0.7833000      0.1196000     -1.1300000E-02
 C   -1.493100       1.112100     -0.1655000    
 C   -2.687900      -1.175000      0.8575000    
 C    1.508700       1.122500      0.6628000    
 C    2.879900     -0.6293000     -0.9986000    
 C  -0.4157000      -4.717500      0.6181000    
 C   -2.878900       1.060200     -1.3100000E-02
 C   -3.476700     -8.4899999E-02  0.4966000    
 C    2.889700       1.246800      0.5091000    
 C    3.575600      0.3695000     -0.3209000    
 C  -0.8412000       2.285600      -2.128500    
 C   -3.918200       3.098900      0.6348000    
 C    4.975500       2.288600      0.9784000    
 H   0.6963000      -3.995500      -1.585100    
 H    1.677800      -3.352400     -0.2738000    
 H  -0.2000000      -1.574900      -1.960700    
 H    1.357600      -2.053900      -2.545900    
 H   0.4966000      -2.105200       1.518700    
 H   -1.017200      -2.783200       2.003300    
 H   -3.173700      -2.064900       1.251900    
 H   0.9942000       1.812200       1.330700    
 H    3.432900      -1.311000      -1.641200    
 H   0.4530000      -4.885700       1.265000    
 H  -0.4080000      -5.472000     -0.1766000    
 H   -1.324900      -4.897900       1.202900    
 H   -4.555400     -0.1396000      0.6140000    
 H    4.647000      0.4033000     -0.4855000    
 H  -0.3147000       3.203400      -2.404700    
 H   -1.834000       2.303500      -2.588900    
 H  -0.2714000       1.431700      -2.507700    
 H   -2.984200       3.550500      0.9839000    
 H   -4.456900       2.651800       1.476300    
 H   -4.542500       3.881900      0.1959000    
 H    5.225400       2.514300     -6.3900001E-02
 H    5.475100       1.382600       1.337900    
 H    5.348200       3.121100       1.584100    


%chk=000159019-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159019

0 1
O -0.977473 2.307401 -0.558141
O -3.818222 2.058533 -0.305011
O 3.505123 2.291758 1.206086
N -0.374370 -3.491096 0.079732
C 0.729513 -3.324574 -0.890157
C 0.754311 -1.943967 -1.607374
C -0.454425 -2.424838 1.122408
C -0.698409 -0.011636 0.220160
C -1.290198 -1.220075 0.693819
C 1.464605 -0.832962 -0.841421
C 0.779017 0.094424 0.006813
C -1.543965 1.091797 -0.092619
C -2.700046 -1.303734 0.806182
C 1.503511 1.120212 0.655766
C 2.866683 -0.695197 -0.981560
C -0.383253 -4.855005 0.645398
C -2.954617 0.999765 0.054607
C -3.531504 -0.211307 0.492704
C 2.903308 1.233007 0.501466
C 3.600152 0.315084 -0.321623
C -1.035387 2.451014 -2.029305
C -3.636393 3.317916 0.453770
C 4.952753 2.451087 1.068568
H 0.606007 -4.116221 -1.655211
H 1.731231 -3.488109 -0.410427
H -0.285638 -1.668216 -1.857467
H 1.288053 -2.093355 -2.565721
H 0.557837 -2.097266 1.452627
H -0.943439 -2.876902 2.005384
H -3.146872 -2.242603 1.152506
H 0.986403 1.846737 1.287620
H 3.402145 -1.394506 -1.636104
H 0.527908 -5.100783 1.249131
H -0.449436 -5.593720 -0.174640
H -1.268365 -4.987987 1.292645
H -4.620547 -0.267982 0.586000
H 4.683270 0.380279 -0.462546
H -0.596630 3.436143 -2.250838
H -2.083475 2.408721 -2.380532
H -0.436798 1.656278 -2.514145
H -2.606599 3.698135 0.340879
H -3.865173 3.151173 1.524036
H -4.362621 4.023629 0.021851
H 5.240454 2.645223 0.016310
H 5.496115 1.559933 1.440651
H 5.206656 3.323894 1.688223


