%chk=000161750.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161750

0 1
 O  -3.5000001E-03  1.6000000E-03  -1.132500    
 O   -5.744800      0.4845000      0.2947000    
 O    5.459900      0.2816000       1.169400    
 O   -4.923900      -1.573900     -0.2107000    
 O    5.158700      0.9354000     -0.9866000    
 N   -2.465100      -1.291400      -1.449900    
 N    2.454900       1.299600      -1.453800    
 C   -1.085700      0.4216000     -0.4179000    
 C    1.102100     -0.4360000     -0.4246000    
 C   -2.324700     -0.2042000     -0.5563000    
 C    2.323200      0.1985000     -0.5759000    
 C   -3.418500      0.2430000      0.1850000    
 C    3.424200     -0.2600000      0.1475000    
 C  -0.9407000       1.494700      0.4617000    
 C   0.9492000      -1.516100      0.4288000    
 C   -3.273200       1.315800       1.064600    
 C    3.287600      -1.346500       1.011600    
 C   -2.034500       1.941500       1.203000    
 C    2.050100      -1.974500       1.152300    
 C   -4.727000     -0.3879000      6.4999998E-02
 C    4.731500      0.3727000      2.4499999E-02
 H   1.3200000E-02   2.002500      0.5758000    
 H  -4.0000002E-03  -2.024200      0.5406000    
 H   -4.101600       1.680200       1.666600    
 H    4.128300      -1.737500       1.578700    
 H   -1.921000       2.776400       1.888300    
 H    1.944900      -2.824100       1.820600    
 H   -1.662200      -1.605900      -1.979100    
 H   -3.355400      -1.752700      -1.573400    
 H    1.645500       1.624600      -1.966600    
 H    3.337900       1.779100      -1.559500    
 H   -6.621700      5.2400000E-02  0.2129000    
 H    6.337900      0.7098000       1.078800    


%chk=000161750-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161750

0 1
O 0.003860 0.043335 -0.612153
O -6.058615 0.296080 -0.005516
O 6.043187 -0.301279 0.149869
O -4.982591 -0.789449 -1.743699
O 5.028302 0.786653 -1.623185
N -2.281028 -0.786943 -1.762261
N 2.327956 0.828174 -1.708232
C -1.200819 0.372557 0.074126
C 1.184267 -0.301790 0.107870
C -2.390137 -0.059464 -0.602146
C 2.396922 0.107455 -0.540766
C -3.653413 0.307207 -0.012840
C 3.639016 -0.274283 0.082598
C -1.243178 1.125605 1.250646
C 1.185364 -1.045586 1.290921
C -3.683733 1.065912 1.194085
C 3.627388 -1.023809 1.295730
C -2.498651 1.471999 1.822575
C 2.420741 -1.406260 1.897082
C -4.893988 -0.114534 -0.670382
C 4.902058 0.122081 -0.547138
H -0.308720 1.444808 1.723651
H 0.234748 -1.347233 1.742661
H -4.658927 1.323992 1.614708
H 4.587572 -1.293757 1.742565
H -2.530636 2.058891 2.744923
H 2.420158 -1.985985 2.824513
H -1.353858 -1.018196 -2.111872
H -3.144341 -1.087124 -2.227025
H 1.413448 1.071602 -2.082057
H 3.207095 1.112017 -2.153176
H -6.841803 -0.033203 -0.522298
H 6.843958 0.011127 -0.350178


