%chk=000084257.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084257

0 1
 O   -3.923300       1.806700      0.1773000    
 O   -4.695200     -0.4372000     -0.2404000    
 O    3.571000      0.5643000     -0.2134000    
 O    1.241900       1.535700      0.4566000    
 O    3.893500      -1.569600      0.6240000    
 N  -0.1562000      -2.205700     -0.2481000    
 C  -0.6506000      0.1539000      0.1097000    
 C   -1.095100      -1.171600     -0.1366000    
 C   -2.897800      0.9149000      9.4599999E-02
 C   -3.339000     -0.3671000     -0.1439000    
 C   -1.557400       1.213300      0.2276000    
 C   -2.465800      -1.430200     -0.2645000    
 C   0.8112000      0.4094000      0.2428000    
 C    1.726400     -0.7608000      0.1071000    
 C    1.183500      -1.962900     -0.1248000    
 C   -5.058200      0.9433000     -3.6600001E-02
 C    3.182400     -0.6647000      0.2131000    
 C    4.980000      0.8131000     -0.1704000    
 C    5.248800       2.215200     -0.6740000    
 H   -1.234500       2.231200      0.4154000    
 H   -2.834300      -2.433300     -0.4527000    
 H  -0.4658000      -3.152000     -0.4248000    
 H    1.774200      -2.864700     -0.2406000    
 H   -5.717500       1.007600      0.8366000    
 H   -5.606200       1.295900     -0.9180000    
 H    5.336400      0.7152000      0.8611000    
 H    5.498600      8.5699998E-02 -0.8049000    
 H    6.318900       2.439700     -0.6541000    
 H    4.881400       2.333500      -1.698800    
 H    4.720900       2.952600     -6.0199998E-02


%chk=000084257-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084257

0 1
O -4.104444 1.778593 -0.025812
O -4.833677 -0.510199 0.029415
O 3.690566 0.677881 -0.199530
O 1.125729 1.744851 -0.143034
O 3.897385 -1.636710 -0.143224
N -0.187265 -2.203184 -0.046344
C -0.693114 0.172820 -0.075750
C -1.151252 -1.178497 -0.042363
C -2.988529 0.905236 -0.035975
C -3.428240 -0.445111 -0.003275
C -1.643409 1.238764 -0.072148
C -2.539063 -1.513186 -0.005331
C 0.767808 0.523099 -0.115362
C 1.678009 -0.646551 -0.117056
C 1.155758 -1.937721 -0.082067
C -5.303771 0.908374 0.019628
C 3.168652 -0.600957 -0.152853
C 5.183758 0.768695 -0.234088
C 5.519149 2.255874 -0.271134
H -1.271875 2.266327 -0.098132
H -2.888597 -2.549223 0.019994
H -0.504279 -3.173449 -0.022290
H 1.841287 -2.790710 -0.082690
H -5.859787 1.101879 0.952515
H -5.908635 1.073190 -0.887910
H 5.585165 0.260696 0.661806
H 5.545805 0.225822 -1.126383
H 6.615998 2.392908 -0.295324
H 5.084217 2.732842 -1.165524
H 5.118850 2.769048 0.619343


