%chk=000120940.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120940

0 1
 O   -3.915100       1.978900     -0.7408000    
 N    1.625100       2.876500     -0.2657000    
 N    5.634300      -1.616800     -0.2676000    
 N   -2.748000      0.9133000      0.9545000    
 N   -6.778500      -1.030900     -0.7230000    
 C    1.418900      0.3691000     -0.2109000    
 C    2.359400       1.626200      4.9800001E-02
 C   0.1285000      0.4961000      0.6100000    
 C  -0.5580000       1.835300      0.3328000    
 C   0.4122000       2.999400      0.5625000    
 C    3.725900       1.520200     -0.7310000    
 C    2.162600     -0.9326000      3.8699999E-02
 C    3.549600     -0.9133000     -0.1543000    
 C    4.354100      0.1864000     -0.5127000    
 C   -1.803800       1.990700       1.204600    
 C    2.444700       4.079000     -8.8799998E-02
 C    4.347100      -2.031900     -3.1999999E-03
 C    1.605400      -2.175000      0.3689000    
 C    5.648600     -0.2729000     -0.5808000    
 C    3.805300      -3.267500      0.3478000    
 C    2.413600      -3.312700      0.5266000    
 C   -3.731500       1.008900     -1.0100000E-02
 C   -4.633100     -0.1665000     -0.1239000    
 C   -4.183500      -1.411300      0.2437000    
 C   -5.908200     -4.4999998E-03 -0.5948000    
 C   -5.050000      -2.492400      0.1260000    
 C   -6.325600      -2.251400     -0.3583000    
 H    1.147300      0.3675000      -1.277200    
 H    2.613100       1.628700       1.122500    
 H  -0.5513000     -0.3241000      0.3530000    
 H   0.3545000      0.3997000       1.680400    
 H  -0.8684000       1.847000     -0.7219000    
 H  -0.1108000       3.929400      0.3040000    
 H   0.6781000       3.065900       1.626500    
 H    4.423200       2.293600     -0.3901000    
 H    3.554000       1.664200      -1.804800    
 H   -2.296400       2.949000       1.005600    
 H   -1.548800       1.955700       2.269500    
 H    1.849000       4.983800     -0.2581000    
 H    3.251900       4.122100     -0.8264000    
 H    2.877100       4.138800      0.9164000    
 H   0.5332000      -2.283400      0.5057000    
 H    6.579500      0.2223000     -0.8183000    
 H    6.451600      -2.210500     -0.2399000    
 H    4.420300      -4.151800      0.4685000    
 H    1.946800      -4.259600      0.7897000    
 H   -2.693000      0.1100000       1.571000    
 H   -3.174200      -1.604500      0.5911000    
 H   -6.304600      0.9606000     -0.8915000    
 H   -4.734600      -3.493600      0.3971000    
 H   -7.039000      -3.061100     -0.4709000    


%chk=000120940-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120940

0 1
O -4.310448 2.231601 -0.261871
N 1.674232 2.818926 -0.302111
N 5.864491 -1.577758 -0.185347
N -2.804017 0.863611 0.878404
N -7.183424 -0.893584 -0.331515
C 1.550694 0.327580 -0.193029
C 2.449676 1.595026 0.062157
C 0.221249 0.435005 0.587507
C -0.520817 1.744529 0.255526
C 0.423525 2.939385 0.488419
C 3.797408 1.542187 -0.728607
C 2.312303 -0.967299 0.099538
C 3.709573 -0.913017 -0.091149
C 4.491663 0.226919 -0.480237
C -1.809133 1.925716 1.096901
C 2.453057 4.075649 -0.220872
C 4.569263 -2.035853 0.092730
C 1.782807 -2.212385 0.495615
C 5.815043 -0.204401 -0.527310
C 4.036281 -3.287457 0.480915
C 2.637869 -3.346060 0.678019
C -3.984722 1.086652 0.183839
C -4.878664 -0.114627 0.005095
C -4.407486 -1.450423 -0.062392
C -6.273924 0.105496 -0.148569
C -5.335118 -2.496940 -0.257135
C -6.706221 -2.174595 -0.380077
H 1.308691 0.351497 -1.278656
H 2.702931 1.605348 1.158505
H -0.418102 -0.435372 0.341536
H 0.433941 0.390514 1.677370
H -0.801363 1.738091 -0.816072
H -0.083004 3.875020 0.184889
H 0.643465 3.021635 1.588729
H 4.445319 2.385681 -0.431204
H 3.561762 1.676212 -1.804856
H -2.307515 2.874906 0.830050
H -1.549992 1.961714 2.174420
H 1.783292 4.923212 -0.450028
H 3.263174 4.086173 -0.967197
H 2.901785 4.255070 0.789163
H 0.708041 -2.336715 0.668464
H 6.727427 0.336990 -0.771751
H 6.713853 -2.136105 -0.144950
H 4.660737 -4.175365 0.627670
H 2.189134 -4.299330 0.981024
H -2.641644 -0.050200 1.302246
H -3.335887 -1.676370 -0.003889
H -6.659685 1.129937 -0.128705
H -5.005971 -3.538383 -0.325759
H -7.457046 -2.958046 -0.533542


