%chk=000003044.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003044

0 1
 O   -2.320900      7.5400002E-02   1.171100    
 O   -2.753200      -1.504500      -1.380800    
 N  -0.1320000     -4.4199999E-02  0.2529000    
 N    1.282000      -1.768400      0.3753000    
 N    1.450000       1.758600     -0.1355000    
 N    3.743700      0.9284000     -0.2146000    
 N    4.282300      -1.386700      6.3000001E-02
 C   -1.399200      0.6916000      0.2571000    
 C   -2.071900      0.7663000      -1.111000    
 C   -3.218300     -0.2133000      -1.000100    
 C   -3.555000     -0.2002000      0.4832000    
 C   -4.556900      0.8865000      0.8526000    
 C    1.121100      0.4749000      7.2899997E-02
 C   2.0099999E-02  -1.396300      0.4310000    
 C    1.981100     -0.6089000      0.1519000    
 C    3.338900     -0.3468000     -1.1000000E-03
 C    2.788300       1.887700     -0.2678000    
 H   -1.172400       1.694500      0.6368000    
 H   -2.472400       1.777700      -1.250700    
 H   -1.389500      0.5549000      -1.940500    
 H   -4.061500      4.1800000E-02  -1.648900    
 H   -3.921200      -1.171700      0.8319000    
 H   -5.515400      0.7259000      0.3500000    
 H   -4.727200      0.8907000       1.934800    
 H   -4.186800       1.884000      0.5930000    
 H  -0.8165000      -2.060800      0.5983000    
 H   -3.489100      -2.127600      -1.255100    
 H    3.148100       2.896500     -0.4401000    
 H    3.982600      -2.339300      0.2213000    
 H    5.263200      -1.171200     -5.2299999E-02


%chk=000003044-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003044

0 1
O -2.125350 0.429435 1.041486
O -2.974868 -1.804445 -1.004949
N -0.112238 -0.043837 -0.206675
N 1.343510 -1.819840 -0.276340
N 1.510714 1.788597 0.247272
N 3.820976 0.954615 0.406704
N 4.383850 -1.328081 0.152509
C -1.348569 0.744638 -0.179371
C -2.307786 0.496182 -1.374190
C -3.422655 -0.410482 -0.818603
C -3.500151 -0.005813 0.676017
C -4.504349 1.124844 0.950046
C 1.164753 0.486970 0.031809
C 0.058803 -1.431910 -0.378636
C 2.046504 -0.624104 -0.020312
C 3.429878 -0.345372 0.180018
C 2.858925 1.928703 0.426340
H -1.011326 1.793294 -0.107294
H -2.736175 1.455992 -1.707842
H -1.802810 0.023598 -2.230440
H -4.390087 -0.254465 -1.335379
H -3.720361 -0.880157 1.318501
H -5.544272 0.775293 0.806277
H -4.396407 1.473727 1.990521
H -4.329231 1.988775 0.283442
H -0.793827 -2.076125 -0.581762
H -3.641897 -2.421038 -0.610279
H 3.218999 2.945666 0.608600
H 4.109506 -2.294142 -0.011709
H 5.357940 -1.075021 0.302841


