%chk=000122256.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122256

1 1
 O   -3.823500      -1.378400     -2.9700000E-02
 O    3.670500      -1.267600     -3.9500002E-02
 N   -4.846700      0.6223000      0.3056000    
 N    4.904100      0.6380000      0.3374000    
 C   -5.043700       2.020400      0.5540000    
 C    5.354400       1.980500      0.6071000    
 C   -5.825700     -0.3284000      0.1151000    
 C    5.776800     -0.4188000      0.1250000    
 C   -3.730100     -4.4300001E-02  0.2103000    
 C    3.620000      0.1205000      0.2378000    
 C   -5.097800       2.843700     -0.7297000    
 C    5.553400       2.745100     -0.6992000    
 C   -5.195300      -1.557400     -9.0800002E-02
 C    5.017900      -1.575700     -0.1042000    
 C   -7.214500     -0.2224000      0.1047000    
 C    7.154300     -0.4852000      0.1090000    
 C   -5.885700      -2.740800     -0.3165000    
 C    5.574700      -2.810000     -0.3514000    
 C   -2.461000      0.6060000      0.3535000    
 C    2.436300      0.7309000      0.3636000    
 C   -5.367700       4.318700     -0.4750000    
 C    6.049700       4.159600     -0.4429000    
 C   -7.932700      -1.405500     -0.1216000    
 C    7.749700      -1.728200     -0.1402000    
 C   -7.283000      -2.633500     -0.3269000    
 C    6.967900      -2.877900     -0.3680000    
 C   -1.281100     -2.2000000E-02  0.2242000    
 C    1.171200      4.5600001E-02  0.2304000    
 C  -1.2400000E-02  0.6645000      0.3579000    
 H   -4.280400       2.407800       1.236900    
 H   -5.988000       2.144100       1.099800    
 H    4.616200       2.505300       1.226300    
 H    6.279700       1.977700       1.196200    
 H   -4.151700       2.740500      -1.273700    
 H   -5.879000       2.446300      -1.388400    
 H    4.610200       2.788500      -1.257000    
 H    6.275000       2.224000      -1.339500    
 H   -7.733000      0.7171000      0.2584000    
 H    7.775000      0.3874000      0.2784000    
 H   -5.381200      -3.685600     -0.4744000    
 H    4.966100      -3.688900     -0.5254000    
 H   -2.442600       1.672500      0.5557000    
 H    2.403300       1.796600      0.5743000    
 H   -4.583100       4.756600      0.1501000    
 H   -6.328400       4.458500      3.0300001E-02
 H   -5.396800       4.868500      -1.420800    
 H    6.183700       4.691500      -1.390000    
 H    7.011600       4.149100      7.9599999E-02
 H    5.333700       4.722500      0.1645000    
 H   -9.019600      -1.371000     -0.1392000    
 H    8.833700      -1.808800     -0.1595000    
 H   -7.880700      -3.525800     -0.4989000    
 H    7.459100      -3.828400     -0.5588000    
 H   -1.244100      -1.087400      9.8999999E-03
 H    1.191200      -1.020400      1.7000001E-02
 H  -4.6399999E-02   1.730700      0.5715000    


%chk=000122256-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122256

1 1
O -3.708167 -1.127879 -0.010921
O 3.717646 -1.284000 -0.001164
N -4.962404 0.729936 0.347753
N 5.047110 0.520096 0.361108
C -5.342833 2.141664 0.568144
C 5.486911 1.914172 0.583065
C -5.869906 -0.335286 0.112354
C 5.909925 -0.581625 0.127268
C -3.666911 0.250380 0.257935
C 3.732925 0.095014 0.267772
C -5.422848 2.956323 -0.744615
C 5.626958 2.717394 -0.731580
C -5.084500 -1.491711 -0.101926
C 5.077823 -1.704460 -0.089273
C -7.273970 -0.401899 0.075244
C 7.310096 -0.705866 0.092393
C -5.619610 -2.753803 -0.356930
C 5.561140 -2.987255 -0.344814
C -2.451839 0.936383 0.396835
C 2.547187 0.831188 0.402556
C -5.846575 4.414354 -0.469371
C 6.120944 4.153355 -0.457829
C -7.841292 -1.673886 -0.181985
C 7.825092 -1.999766 -0.165552
C -7.036119 -2.824285 -0.393161
C 6.973610 -3.115831 -0.379201
C -1.198320 0.298419 0.287313
C 1.268231 0.246479 0.290546
C 0.048924 0.943772 0.416649
H -4.614466 2.595919 1.263797
H -6.320278 2.145388 1.082491
H 4.767367 2.403935 1.263414
H 6.454137 1.876290 1.115456
H -4.438748 2.934960 -1.250591
H -6.145059 2.474163 -1.430301
H 4.650030 2.743843 -1.251169
H 6.332858 2.195507 -1.405107
H -7.906660 0.475990 0.232682
H 7.978187 0.144974 0.252073
H -4.987904 -3.630311 -0.517707
H 4.894191 -3.836878 -0.507613
H -2.499959 2.011723 0.594926
H 2.639740 1.903946 0.598933
H -5.124429 4.929556 0.190967
H -6.840427 4.462873 0.012814
H -5.905084 4.986307 -1.410997
H 6.216175 4.717557 -1.401166
H 7.111851 4.154361 0.032770
H 5.419882 4.707219 0.193817
H -8.930491 -1.771429 -0.219956
H 8.909416 -2.141946 -0.202080
H -7.516395 -3.787386 -0.589161
H 7.414122 -4.097662 -0.575705
H -1.196581 -0.781931 0.082856
H 1.221506 -0.833020 0.086889
H 0.071294 2.023272 0.622355


