%chk=000155897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155897

0 1
 O    5.205100      -1.516100     -0.1533000    
 O    5.959600      0.7065000      0.3882000    
 O   -4.783600     -0.2926000       1.883800    
 O   -5.870700     -3.1300001E-02 -0.2511000    
 O   -1.752200       1.174500      -2.424500    
 O  -0.6901000      -3.536100      0.4081000    
 N   5.0600000E-02  -1.429100     -0.4309000    
 C    1.897800      9.7199999E-02  1.8500000E-02
 C   0.5217000     -0.1440000     -0.1150000    
 C  -0.4025000      0.8861000      6.2300000E-02
 C    2.344600       1.413500      0.3391000    
 C   -1.829700      0.6565000     -7.1699999E-02
 C    2.834400     -0.9360000     -0.1591000    
 C   3.3500001E-02   2.170600      0.3751000    
 C    1.396900       2.433600      0.5129000    
 C    4.174100     -0.6384000     -1.5300000E-02
 C    3.719700       1.671700      0.4761000    
 C    4.604200      0.6285000      0.2932000    
 C   -2.559500      0.2832000       1.058100    
 C   -2.461900      0.8092000      -1.317000    
 C   -3.914400      7.2700001E-02  0.9026000    
 C   -4.535100      0.2218000     -0.3165000    
 C   -3.835400      0.5896000      -1.447300    
 C    6.334100     -0.6568000      0.1043000    
 C  -0.1474000      -1.887000      -1.826600    
 C   -6.021000     -0.3577000       1.145700    
 C  -0.2729000      -2.390100      0.5607000    
 H    2.547200      -1.953500     -0.4040000    
 H  -0.6743000       2.984400      0.5159000    
 H    1.712300       3.445900      0.7576000    
 H    4.086500       2.664500      0.7194000    
 H   -2.090000      0.1603000       2.029100    
 H   -4.334500      0.7044000      -2.403300    
 H    6.989400     -0.6652000     -0.7742000    
 H    6.889500      -1.054200      0.9617000    
 H   0.4156000      -2.812800      -1.978700    
 H   0.1982000      -1.122300      -2.527400    
 H   -1.211300      -2.089500      -1.981000    
 H   -6.425100      -1.373300       1.227300    
 H   -6.734800      0.3423000       1.594800    
 H  -9.8899998E-02  -1.980900       1.571600    
 H  -0.8134000       1.297300      -2.214100    


%chk=000155897-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155897

0 1
O 5.327959 -1.604458 0.035363
O 6.117656 0.649469 0.246099
O -4.838214 -0.834209 1.631577
O -6.053277 0.218320 -0.146505
O -2.014681 2.081889 -2.206906
O -0.284988 -3.601805 0.858174
N 0.058661 -1.527683 -0.200688
C 1.948735 0.067193 0.013868
C 0.527562 -0.165961 -0.069069
C -0.394046 0.906505 -0.080141
C 2.432653 1.436270 0.114592
C -1.874143 0.707894 -0.142439
C 2.893247 -1.024115 -0.018356
C 0.114523 2.248011 0.001670
C 1.482561 2.503473 0.104855
C 4.235032 -0.711055 0.070922
C 3.844768 1.709781 0.211459
C 4.707276 0.632496 0.192099
C -2.560653 -0.067993 0.842104
C -2.626175 1.335478 -1.182587
C -3.943521 -0.179958 0.739398
C -4.666190 0.449616 -0.299630
C -4.039086 1.218310 -1.277284
C 6.539348 -0.776916 0.271042
C -0.454456 -1.987970 -1.507682
C -6.147223 -0.803394 0.936404
C 0.083888 -2.395827 0.887350
H 2.556809 -2.057413 -0.118854
H -0.600548 3.076924 0.049555
H 1.842195 3.535131 0.190278
H 4.207735 2.737643 0.291835
H -2.014734 -0.540725 1.661379
H -4.579468 1.709096 -2.088360
H 7.257533 -0.952149 -0.545136
H 6.948523 -1.013339 1.269297
H -0.728551 -3.050302 -1.402125
H 0.322045 -1.880727 -2.286453
H -1.347461 -1.408267 -1.801901
H -6.340493 -1.790764 0.474972
H -6.926952 -0.496469 1.648854
H 0.472126 -1.901365 1.805696
H -1.029674 2.096764 -2.079626


