%chk=000095855.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095855

0 1
 O    3.801800       1.706900     -8.7399997E-02
 O    2.356800      -2.663200     -2.0099999E-02
 N    3.048500     -0.4681000     -5.7200000E-02
 C   0.3906000      0.4136000      0.1251000    
 C  -0.9939000      0.8636000     -0.3762000    
 C    1.457000       1.365200     -0.4331000    
 C   0.6745000      -1.001200     -0.3965000    
 C   -2.088400     -3.1399999E-02  0.1851000    
 C   0.3760000      0.4422000       1.665400    
 C   -3.464300      0.4364000     -0.2922000    
 C    2.870300      0.9053000     -0.1601000    
 C    2.086000      -1.466900     -0.1236000    
 C   -4.574400     -0.4723000      0.2352000    
 C   -5.940500     -3.0099999E-02 -0.2644000    
 H   -1.026000      0.8439000      -1.473300    
 H   -1.180300       1.903800     -7.7900000E-02
 H    1.335100       2.366400     -2.0000001E-03
 H    1.359300       1.460600      -1.522000    
 H   0.5244000      -1.055800      -1.482100    
 H   1.6200000E-02  -1.741300      7.1000002E-02
 H   -1.959200      -1.069200     -0.1363000    
 H   -2.103900     -1.9400001E-02   1.278800    
 H  -4.1900001E-02   1.382300       2.043100    
 H  -0.1919000     -0.3883000       2.096900    
 H    1.386700      0.3584000       2.080200    
 H   -3.642000       1.465800      4.2500000E-02
 H   -3.489500      0.4444000      -1.389000    
 H    4.001600     -0.7807000      0.1071000    
 H   -4.394400      -1.505500     -8.3800003E-02
 H   -4.572000     -0.4659000       1.331400    
 H   -6.166600      0.9898000      6.2899999E-02
 H   -6.719500     -0.6926000      0.1257000    
 H   -5.986700     -5.8499999E-02  -1.357700    


%chk=000095855-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095855

0 1
O 3.842585 1.821503 -0.208147
O 2.632937 -2.643733 -0.005001
N 3.168818 -0.394248 -0.135467
C 0.423187 0.366099 0.197160
C -1.005550 0.773175 -0.277419
C 1.435941 1.360882 -0.441836
C 0.774275 -1.061834 -0.311069
C -2.177514 -0.106858 0.213571
C 0.529751 0.431114 1.744024
C -3.543199 0.403276 -0.302482
C 2.899060 0.988474 -0.246637
C 2.235457 -1.455392 -0.131362
C -4.736111 -0.458047 0.170780
C -6.095279 0.066903 -0.340314
H -1.016007 0.784571 -1.388713
H -1.189419 1.819614 0.044876
H 1.304319 2.381335 -0.041682
H 1.257021 1.423353 -1.535924
H 0.544892 -1.138978 -1.394897
H 0.174479 -1.837202 0.194152
H -2.036430 -1.154013 -0.122569
H -2.200637 -0.129953 1.321185
H 0.243369 1.434165 2.110804
H -0.135052 -0.309216 2.222424
H 1.558044 0.227047 2.095183
H -3.694238 1.450899 0.032801
H -3.530902 0.431690 -1.412401
H 4.156167 -0.657861 -0.023105
H -4.589888 -1.503306 -0.170043
H -4.744650 -0.490972 1.279476
H -6.280220 1.098673 0.013894
H -6.931396 -0.565268 0.010480
H -6.124410 0.082310 -1.446244


