%chk=000131961.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131961

0 1
 O   0.3713000       1.346300      -1.255500    
 O    2.835400      -1.545500       1.512200    
 O  -0.3781000      -2.980600       2.208200    
 O    1.614600      -3.972000       1.724400    
 N  -0.7976000       2.630500      0.1934000    
 C    1.421100       3.425900     -0.6689000    
 C    2.560100       3.194900      0.3575000    
 C   0.2886000       2.497300     -0.5336000    
 C    3.215100       1.841900      0.2212000    
 C  -0.7834000      0.6930000     -0.9467000    
 C   -1.484100       1.476800     -6.9799997E-02
 C  -0.9694000     -0.5805000      -1.580100    
 C   -2.760000       1.156500      0.5055000    
 C    2.712800      0.7686000      0.9398000    
 C    4.306600       1.697300     -0.6205000    
 C    3.317800     -0.4820000      0.8134000    
 C    4.911600      0.4470000     -0.7470000    
 C   -2.258000      -1.043100      -1.868000    
 C   0.1352000      -1.371300      -1.914600    
 C   -2.826000      0.4592000       1.711800    
 C   -3.933700       1.542800     -0.1419000    
 C    4.417100     -0.6427000     -3.0200001E-02
 C   -2.440000      -2.281900      -2.482900    
 C  -4.6799999E-02  -2.610000      -2.529600    
 C   -4.065500      0.1478000       2.270600    
 C   -5.173300       1.231400      0.4171000    
 C   -1.334400      -3.065200      -2.813700    
 C   -5.239000      0.5339000       1.623300    
 C    1.439100      -1.549900       1.806300    
 C   0.9429000      -2.966200       1.898400    
 H    1.828300       3.364200      -1.686100    
 H    1.052400       4.451600     -0.5460000    
 H    2.170100       3.312600       1.377300    
 H    3.315800       3.981500      0.2354000    
 H    1.875200      0.9298000       1.611900    
 H    4.697000       2.539400      -1.184800    
 H    5.766900      0.3215000      -1.404500    
 H   -3.145800     -0.4590000      -1.662900    
 H    1.150200      -1.044900      -1.700400    
 H   -1.920100      0.1501000       2.228400    
 H   -3.900100       2.088900      -1.081800    
 H    4.891800      -1.614600     -0.1335000    
 H   -3.441900      -2.633500      -2.711300    
 H   0.8139000      -3.220800      -2.785800    
 H   -4.116800     -0.3957000       3.209500    
 H   -6.087200       1.532100     -8.6700000E-02
 H   -1.475900      -4.029000      -3.293800    
 H   -6.204100      0.2914000       2.058300    
 H   0.8565000      -1.066000       1.015900    
 H    1.278400      -1.060800       2.772700    
 H  -0.7289000      -3.894300       2.273700    


%chk=000131961-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131961

0 1
O 0.330835 1.110434 -1.777857
O 2.594053 -1.389635 1.546843
O -0.665980 -2.918675 2.015630
O 1.465930 -3.831354 2.240897
N -0.725458 2.459635 -0.278080
C 1.453359 3.291547 -1.296368
C 2.352650 3.406587 -0.016906
C 0.309469 2.350440 -1.099603
C 3.127900 2.133707 0.296910
C -0.816394 0.403017 -1.306217
C -1.448418 1.235064 -0.371700
C -1.053117 -0.905613 -1.921570
C -2.619782 1.021755 0.501400
C 2.455696 0.996914 0.822468
C 4.517875 2.055764 0.043329
C 3.171705 -0.198733 1.060082
C 5.229363 0.860257 0.310567
C -2.361980 -1.458608 -2.006634
C 0.038289 -1.635180 -2.475585
C -2.933311 -0.253105 1.047891
C -3.422852 2.139247 0.859232
C 4.564443 -0.272510 0.814594
C -2.567186 -2.714146 -2.613359
C -0.174685 -2.889885 -3.082500
C -4.042965 -0.406913 1.905601
C -4.533662 1.980007 1.713586
C -1.476615 -3.438809 -3.150857
C -4.853406 0.704681 2.236331
C 1.146316 -1.429910 1.648472
C 0.741248 -2.853422 1.999732
H 2.057581 2.953483 -2.155530
H 1.050660 4.293989 -1.531218
H 1.696716 3.685981 0.828713
H 3.059639 4.241171 -0.176927
H 1.388208 1.070805 1.054553
H 5.045003 2.929102 -0.357925
H 6.307077 0.811012 0.120052
H -3.216142 -0.899024 -1.613291
H 1.045726 -1.208859 -2.429386
H -2.296430 -1.118191 0.834550
H -3.156528 3.125249 0.465524
H 5.088402 -1.210640 1.019488
H -3.581694 -3.123014 -2.676493
H 0.675619 -3.439699 -3.500466
H -4.266356 -1.393375 2.327048
H -5.147040 2.849477 1.975199
H -1.640491 -4.414034 -3.622180
H -5.714889 0.581156 2.902073
H 0.658555 -1.148901 0.692907
H 0.766461 -0.748280 2.437575
H -0.947695 -3.845269 2.245005


