%chk=000121101.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121101

0 1
 O   -6.571200       1.474500      0.2808000    
 O   -7.297700      -1.194400      1.2200000E-02
 O    5.306400      -2.940800      0.3967000    
 O    3.357400      -1.932000      0.3504000    
 N   0.2573000      0.7716000      0.1089000    
 N    3.102300      0.5253000      4.2800002E-02
 N    4.608900      -1.904800      0.2929000    
 C    1.033600      0.7969000       1.354800    
 C   0.9040000     -0.1168000     -0.8644000    
 C    2.455400       1.305400       1.105300    
 C    2.322100      0.3602000      -1.187500    
 C   -1.114700      0.3366000      0.3684000    
 C   -1.961400      0.3951000     -0.9056000    
 C    4.500400      0.5286000     -1.7200001E-02
 C   -3.381000     -2.4400000E-02 -0.6609000    
 C    5.260900     -0.6540000      0.1036000    
 C    5.195200       1.741500     -0.2039000    
 C   -4.327500      0.9279000     -0.2999000    
 C   -3.737000      -1.361600     -0.7970000    
 C    6.654000     -0.6238000      3.9999999E-02
 C    6.588400       1.771500     -0.2672000    
 C    7.317800      0.5889000     -0.1452000    
 C   -5.647300      0.5379000     -7.1800001E-02
 C   -5.056500      -1.751500     -0.5690000    
 C   -6.011700     -0.8018000     -0.2066000    
 C   -6.117100       2.821600      0.3971000    
 C   -7.641100      -1.577500       1.342400    
 H    1.075700     -0.2038000       1.805700    
 H   0.5556000       1.463200       2.083200    
 H   0.3847000     -0.1231000      -1.826000    
 H   0.9263000      -1.150200     -0.4959000    
 H    3.024300       1.223500       2.039900    
 H    2.428800       2.365700      0.8237000    
 H    2.286000       1.317300      -1.723800    
 H    2.799100     -0.3669000      -1.856200    
 H   -1.568700      0.9972000       1.118800    
 H   -1.134300     -0.6781000      0.7894000    
 H   -1.943100       1.409200      -1.326800    
 H   -1.578600     -0.2604000      -1.694400    
 H    4.647800       2.675900     -0.3084000    
 H   -3.983900       1.952700     -0.2085000    
 H   -3.001100      -2.110600      -1.076300    
 H    7.258900      -1.522400      0.1303000    
 H    7.105300       2.715500     -0.4131000    
 H    8.402500      0.6129000     -0.1951000    
 H   -5.333400      -2.796800     -0.6759000    
 H   -6.981800       3.429000      0.6840000    
 H   -5.374600       2.929900       1.195000    
 H   -5.759700       3.211600     -0.5621000    
 H   -8.698500      -1.855300       1.356800    
 H   -7.488600     -0.7441000       2.035300    
 H   -7.047700      -2.441700       1.657500    


%chk=000121101-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121101

0 1
O -6.672297 1.384022 0.276379
O -7.407269 -1.363651 0.388608
O 5.731168 -2.568083 -1.473842
O 3.711504 -2.128203 -0.523610
N 0.305754 0.534656 -0.014488
N 3.203160 0.628702 0.039388
N 4.921337 -1.774697 -0.839121
C 1.046277 0.804797 1.240356
C 1.111061 -0.368102 -0.880587
C 2.403724 1.477080 0.950392
C 2.462582 0.286986 -1.200293
C -1.064102 0.027415 0.251645
C -1.977325 0.062342 -1.002561
C 4.594234 0.590844 0.126238
C -3.415137 -0.294165 -0.654705
C 5.431694 -0.463688 -0.403672
C 5.290129 1.675758 0.762517
C -4.351898 0.725877 -0.347789
C -3.838639 -1.642824 -0.591568
C 6.849424 -0.351714 -0.396096
C 6.687952 1.751628 0.801977
C 7.485668 0.744865 0.196717
C -5.683167 0.416321 0.015414
C -5.159781 -1.961003 -0.208617
C -6.092584 -0.950775 0.105399
C -6.309987 2.790014 0.088822
C -8.046934 -0.833032 1.609831
H 1.231687 -0.131953 1.824484
H 0.444753 1.486922 1.870016
H 0.572739 -0.537093 -1.829125
H 1.292607 -1.356107 -0.396688
H 2.941154 1.602270 1.905235
H 2.223933 2.479968 0.503451
H 2.274602 1.232252 -1.756050
H 3.058665 -0.376240 -1.838570
H -1.516147 0.676092 1.026407
H -1.051657 -1.012317 0.666803
H -1.913861 1.077448 -1.436844
H -1.595562 -0.644638 -1.762741
H 4.707977 2.505071 1.172830
H -4.032133 1.771407 -0.415973
H -3.137095 -2.447528 -0.840240
H 7.419853 -1.174573 -0.834401
H 7.163255 2.616386 1.278374
H 8.577312 0.811790 0.207427
H -5.503864 -2.998633 -0.153380
H -7.230753 3.354130 0.298836
H -5.513579 3.101806 0.792768
H -5.982622 2.983049 -0.951056
H -9.026050 -1.334151 1.655224
H -8.171566 0.260273 1.549212
H -7.449297 -1.096701 2.504465


