%chk=000040751.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040751

0 1
 O   -3.601300     -1.7700000E-02 -0.2782000    
 O    3.598300     -1.9400001E-02  0.2874000    
 N   2.7000001E-03  0.7137000     -4.4999998E-03
 C   -1.199900     -0.1160000     -5.3100001E-02
 C    1.198000     -0.1138000      4.9199998E-02
 C   -2.430400      0.7833000     -0.1769000    
 C    2.429100      0.7836000      0.1809000    
 C   -1.272000      -1.008800       1.186100    
 C    1.275500      -1.004800      -1.190900    
 H   -1.220800     -0.7592000     -0.9397000    
 H    1.216000     -0.7564000      0.9359000    
 H   3.4200002E-02   1.321100     -0.8231000    
 H   -2.540900       1.431500      0.6993000    
 H   -2.376200       1.420500      -1.066500    
 H    2.546800       1.433000     -0.6934000    
 H    2.369100       1.419500       1.071100    
 H   -2.257000      -1.481000       1.272400    
 H   -1.110500     -0.4360000       2.106600    
 H  -0.5529000      -1.833000       1.155700    
 H    2.258600      -1.482900      -1.268300    
 H    1.126900     -0.4313000      -2.113300    
 H   0.5518000      -1.825100      -1.168600    
 H   -3.516100     -0.5629000      -1.078800    
 H    3.508200     -0.5652000       1.087000    


%chk=000040751-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040751

0 1
O -3.762757 0.195792 -0.226584
O 3.716837 0.188685 0.311258
N -0.018729 0.556144 -0.085191
C -1.293820 -0.203908 -0.043018
C 1.256770 -0.205511 -0.039819
C -2.444846 0.830629 -0.087794
C 2.398715 0.822657 0.148163
C -1.401017 -1.072012 1.224704
C 1.512466 -1.115571 -1.266692
H -1.417668 -0.876060 -0.934438
H 1.227035 -0.836196 0.871409
H -0.013546 1.213126 -0.881178
H -2.492360 1.384438 0.863315
H -2.270602 1.557937 -0.912901
H 2.510791 1.445235 -0.758536
H 2.151243 1.480977 1.005135
H -2.438274 -1.436273 1.329574
H -1.145636 -0.468509 2.114832
H -0.731928 -1.950577 1.190373
H 2.505744 -1.593314 -1.190985
H 1.495410 -0.519775 -2.200347
H 0.747174 -1.909052 -1.349940
H -3.786863 -0.303858 -1.081948
H 3.733061 -0.292304 1.176907


