%chk=000133107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133107

0 1
 O   -4.560200     -0.6017000     -0.1247000    
 N    1.785100     -0.6404000      0.6956000    
 N   -1.993000     -0.4873000      -1.174500    
 N   -1.833400       1.797400     -0.5477000    
 C  -0.7723000      -1.064900     -0.6575000    
 C  -0.6770000     -0.8259000      0.8490000    
 C   0.4320000     -0.4478000      -1.367100    
 C   0.6721000      -1.293900       1.398300    
 C    1.745400     -0.9265000     -0.7454000    
 C    3.065900      -1.058700       1.265100    
 C   -2.562500      0.6494000     -0.5904000    
 C   -2.633600      -1.128000      -2.321300    
 C    4.225300     -0.3436000      0.6239000    
 C   -3.854400      0.5578000     -7.4100003E-02
 C    4.834000     -0.8949000     -0.4951000    
 C    4.669400      0.8569000       1.160700    
 C   -4.419500       1.687200      0.5078000    
 C    5.908300     -0.2324000      -1.088900    
 C    5.743500       1.519500      0.5666000    
 C   -2.415800       2.874500      2.5599999E-02
 C   -3.693100       2.871500      0.5627000    
 C    6.362900      0.9749000     -0.5583000    
 C   -4.971000      -1.169600       1.119600    
 C   -5.058100      -2.673500      0.9703000    
 H  -0.7719000      -2.148800     -0.8357000    
 H   -1.484000      -1.359200       1.367300    
 H  -0.7728000      0.2306000       1.122000    
 H   0.3975000      0.6480000      -1.322900    
 H   0.4173000     -0.7107000      -2.432100    
 H   0.7102000      -1.047600       2.466600    
 H   0.7441000      -2.386300       1.314100    
 H    1.878500      -1.998200     -0.9433000    
 H    2.517000     -0.3790000      -1.292500    
 H    3.208400      -2.145000       1.175700    
 H    3.082300     -0.8468000       2.342800    
 H   -3.284800      -1.943100      -1.990600    
 H   -1.883700      -1.551800      -2.998000    
 H   -3.226900     -0.4120000      -2.900800    
 H    4.502300      -1.842200     -0.9109000    
 H    4.193000       1.291100       2.035200    
 H   -5.425900       1.661200      0.9159000    
 H    6.393100     -0.6582000      -1.962500    
 H    6.097300       2.459600      0.9796000    
 H   -1.807800       3.772900      4.3200001E-02
 H   -4.113900       3.764600       1.010300    
 H    7.199800       1.490300      -1.020400    
 H   -4.256900     -0.9267000       1.916300    
 H   -5.952400     -0.7639000       1.388100    
 H   -5.382700      -3.141400       1.903800    
 H   -5.762300      -2.942300      0.1760000    
 H   -4.085100      -3.088200      0.6862000    


%chk=000133107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133107

0 1
O -4.802589 -0.714424 0.015068
N 2.294297 -0.904848 0.590637
N -1.971949 -1.016544 -0.336326
N -1.678078 1.238023 0.335197
C -0.527343 -1.319401 -0.110027
C -0.069197 -1.148999 1.355766
C 0.449284 -0.570808 -1.056063
C 1.386010 -1.638314 1.504938
C 1.889793 -1.069700 -0.827770
C 3.718010 -1.238978 0.817086
C -2.533677 0.208448 0.041046
C -2.597379 -1.891990 -1.348648
C 4.680908 -0.229212 0.196404
C -3.964514 0.406629 0.187903
C 5.929582 -0.650623 -0.323136
C 4.362646 1.152490 0.177111
C -4.446930 1.680071 0.544435
C 6.850808 0.288622 -0.841973
C 5.278220 2.092417 -0.344754
C -2.164513 2.450928 0.721582
C -3.537423 2.735835 0.810326
C 6.528114 1.665070 -0.853461
C -6.239580 -0.556070 0.318737
C -6.882048 -1.930366 0.145650
H -0.441713 -2.404222 -0.344977
H -0.728961 -1.732978 2.025775
H -0.132560 -0.085679 1.637289
H 0.382032 0.508630 -0.844963
H 0.167203 -0.739837 -2.114038
H 1.729102 -1.474904 2.544236
H 1.425609 -2.746006 1.312611
H 1.969036 -2.148502 -1.136755
H 2.592371 -0.497965 -1.460107
H 3.976435 -2.265500 0.446116
H 3.877000 -1.256225 1.914874
H -2.595703 -2.943542 -1.003606
H -2.034665 -1.840289 -2.305270
H -3.637665 -1.598323 -1.530880
H 6.181745 -1.719088 -0.324122
H 3.385824 1.464169 0.563887
H -5.521469 1.855121 0.648611
H 7.813049 -0.052900 -1.240970
H 5.018953 3.157615 -0.355830
H -1.409918 3.210882 0.955264
H -3.892773 3.730888 1.092856
H 7.238769 2.394923 -1.258063
H -6.354292 -0.183726 1.357548
H -6.686564 0.186001 -0.374866
H -7.962226 -1.873789 0.373058
H -6.762974 -2.291836 -0.890158
H -6.418395 -2.664272 0.826352


