%chk=000122636.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122636

0 1
 O   -2.098900     -0.2620000      0.8883000    
 O   -3.443400       2.380900      2.9300001E-02
 O   -3.963700      -2.319200      0.5633000    
 N   0.1276000     -0.1223000      8.1600003E-02
 N    1.518300      -1.824900     -0.2776000    
 N    4.105600      0.7966000      0.1176000    
 N    4.504300      -1.518000     -0.3203000    
 C   -1.131300      0.5930000      0.2551000    
 C   -1.759300       1.079100      -1.043200    
 C   -3.220800       1.155300     -0.6647000    
 C   -3.392500     -1.5100000E-02  0.2978000    
 C   -3.842200      -1.289800     -0.4026000    
 C    1.392400      0.4118000      0.1372000    
 C   0.2594000      -1.463000     -0.1687000    
 C    2.238700     -0.6688000     -8.9500003E-02
 C    1.853000       1.702300      0.3585000    
 C    3.616800     -0.4504000     -9.5100001E-02
 C    3.235800       1.814500      0.3330000    
 H  -0.9423000       1.423600      0.9448000    
 H   -1.617400      0.3447000      -1.844900    
 H   -1.331500       2.033400      -1.365900    
 H   -3.897100       1.131700      -1.523200    
 H   -4.077400      0.2212000       1.120100    
 H   -3.108800      -1.616700      -1.146800    
 H   -4.812300      -1.147900     -0.8888000    
 H  -0.5902000      -2.124900     -0.2669000    
 H   -2.960800       2.358900      0.8724000    
 H    1.201400       2.547500      0.5328000    
 H   -4.252400      -3.120300      9.3699999E-02
 H    3.705300       2.780900      0.4939000    
 H    4.150400      -2.451600     -0.4795000    
 H    5.499500      -1.340500     -0.3203000    


%chk=000122636-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122636

0 1
O -2.398473 0.024318 1.246162
O -4.084560 2.266015 0.115989
O -3.070124 -2.492382 -0.076343
N -0.095114 -0.044629 0.555511
N 1.191595 -1.937956 0.500591
N 3.886345 0.458815 -0.623194
N 4.108424 -1.875062 -0.326922
C -1.255734 0.839990 0.827012
C -1.718405 1.639332 -0.431542
C -3.228211 1.293460 -0.571877
C -3.329631 -0.102761 0.083068
C -2.971462 -1.256811 -0.860181
C 1.179602 0.374655 0.140084
C -0.025025 -1.436818 0.773077
C 1.956911 -0.819168 0.108566
C 1.742950 1.630608 -0.205535
C 3.327734 -0.742421 -0.284355
C 3.103769 1.586880 -0.575647
H -1.001575 1.489531 1.683851
H -1.150157 1.317655 -1.320542
H -1.593329 2.727025 -0.311360
H -3.576812 1.317283 -1.616016
H -4.322052 -0.284867 0.526215
H -1.952126 -1.128568 -1.280206
H -3.704048 -1.254996 -1.696621
H -0.895783 -1.998632 1.104302
H -3.921690 2.191521 1.092633
H 1.193331 2.575099 -0.191305
H -2.840734 -3.267714 -0.647735
H 3.619137 2.513088 -0.855038
H 3.706881 -2.771389 -0.062082
H 5.084565 -1.791101 -0.599161


