%chk=000122902.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122902

0 1
 O  -0.4095000       2.372200      0.3278000    
 O   -3.452000      -1.979700     -0.2620000    
 N    1.791000      0.9810000      0.5001000    
 N   -1.429000      -3.584300     -0.1243000    
 N    1.876700      -4.842600      0.1785000    
 C  -0.4622000      6.8000001E-03  0.1886000    
 C   -1.256500      -1.131300      3.4200002E-02
 C   0.9237000     -0.1239000      0.3387000    
 C   -2.536600       1.475200      3.5799999E-02
 C   -3.330900      0.3370000     -0.1182000    
 C   -1.073200       1.351700      0.1946000    
 C   -2.719900      -1.007800     -0.1246000    
 C  -0.6649000      -2.400200      2.9300001E-02
 C    1.509100      -1.390300      0.3335000    
 C   0.7166000      -2.526000      0.1791000    
 C   -3.128000       2.744100      3.9900001E-02
 C   -4.716800      0.4678000     -0.2682000    
 C    3.133600       1.195400      0.1418000    
 C   -4.509400       2.869900     -0.1099000    
 C   -5.302100       1.734200     -0.2638000    
 C    3.935700       2.049000      0.9036000    
 C    3.672300      0.5565000     -0.9779000    
 C    1.358400      -3.807700      0.1788000    
 C    5.267600       2.261900      0.5481000    
 C    5.004200      0.7693000      -1.333200    
 C    5.802000       1.621900     -0.5702000    
 H    2.580000      -1.514300      0.4806000    
 H    1.376400       1.753900       1.012200    
 H   -2.534300       3.646500      0.1579000    
 H   -5.359100     -0.4003000     -0.3898000    
 H   -4.967700       3.854700     -0.1068000    
 H   -6.377300       1.835100     -0.3802000    
 H  -0.9862000      -4.492800     -0.1261000    
 H   -2.431600      -3.537200     -0.2363000    
 H    3.531900       2.553300       1.778100    
 H    3.069400     -9.2600003E-02  -1.607300    
 H    5.888800       2.926000       1.141900    
 H    5.418900      0.2758000      -2.207500    
 H    6.838700       1.788700     -0.8477000    


%chk=000122902-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122902

0 1
O -0.381914 2.458868 0.284818
O -3.538501 -2.065242 -0.176047
N 1.756766 1.057961 0.179185
N -1.455842 -3.581019 -0.141610
N 1.811578 -4.937473 0.105079
C -0.476598 0.046360 0.075312
C -1.304722 -1.135045 -0.014446
C 0.963675 -0.076333 0.105779
C -2.568299 1.491758 0.062418
C -3.381472 0.327506 -0.049128
C -1.095106 1.379333 0.144902
C -2.771254 -1.023709 -0.083441
C -0.704790 -2.442366 -0.044416
C 1.537457 -1.387180 0.125594
C 0.740829 -2.532714 0.054227
C -3.176072 2.773879 0.100415
C -4.791941 0.459394 -0.122499
C 3.162335 1.171362 0.012849
C -4.575545 2.895620 0.024550
C -5.386516 1.734356 -0.087248
C 3.838855 2.171262 0.765037
C 3.898207 0.392665 -0.923729
C 1.345604 -3.834777 0.086241
C 5.224333 2.370956 0.599429
C 5.286867 0.592719 -1.072790
C 5.960066 1.576660 -0.312004
H 2.617970 -1.501143 0.237660
H 1.178927 1.927015 0.315193
H -2.526905 3.649973 0.188889
H -5.390629 -0.452493 -0.205691
H -5.041406 3.886485 0.052218
H -6.475850 1.832495 -0.145236
H -1.013086 -4.500090 -0.150397
H -2.483394 -3.439283 -0.190341
H 3.272242 2.776003 1.481970
H 3.383032 -0.328620 -1.566191
H 5.731799 3.142681 1.188552
H 5.839834 -0.010637 -1.801182
H 7.037261 1.729715 -0.434821


