%chk=000104625.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104625

0 1
 O   -1.608000       2.131200     -0.9718000    
 O   -1.781700      -2.357800     -0.4974000    
 O    2.820600     -7.0699997E-02   1.672100    
 O   -1.573700       1.644700       1.247700    
 O   -3.110800     -0.9216000      0.6610000    
 O    3.716100     -0.5589000     -0.3526000    
 N    1.594300      0.3220000      -1.708700    
 C   0.2982000     -0.5047000      0.1988000    
 C   -1.067000     -0.1010000     -0.3893000    
 C    1.470600      0.3810000     -0.2491000    
 C   -1.432900       1.295300      8.4799998E-02
 C   -2.111600      -1.134700     -1.0900000E-02
 C    2.785800     -0.1246000      0.3155000    
 H   0.2351000     -0.4860000       1.295900    
 H   0.5260000      -1.549600     -5.3700000E-02
 H   -1.030600     -9.5899999E-02  -1.486000    
 H    1.338800       1.423000      5.9200000E-02
 H    1.759000     -0.6379000      -2.009400    
 H    2.400700      0.8666000      -2.011400    
 H   -1.852000       3.036800     -0.6846000    
 H   -2.441700      -3.040100     -0.2501000    
 H    3.668400     -0.4104000       2.029900    


%chk=000104625-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104625

0 1
O -2.466700 1.764200 -0.752171
O -1.965037 -2.183158 -0.837242
O 2.932484 0.019073 1.765368
O -0.748961 2.135749 0.762478
O -2.970065 -0.880748 0.803902
O 3.732355 -0.976965 -0.175494
N 1.641320 0.238719 -1.708712
C 0.362190 -0.503199 0.314275
C -0.946601 -0.057092 -0.386112
C 1.591490 0.285554 -0.244383
C -1.341707 1.371230 -0.027814
C -2.078010 -1.024035 -0.056409
C 2.862550 -0.289985 0.404586
H 0.298791 -0.340595 1.403516
H 0.502517 -1.583643 0.123068
H -0.752025 -0.086684 -1.476810
H 1.484770 1.332691 0.088215
H 2.030807 -0.640574 -2.069098
H 2.099744 1.048594 -2.136091
H -2.732662 2.686263 -0.488171
H -2.684100 -2.822516 -0.580927
H 3.750448 -0.386179 2.163925


