%chk=000063131.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063131

0 1
 O  -0.7039000       2.599500     -8.5100003E-02
 N  -0.9215000      -1.373200      3.4299999E-02
 N   -2.018400      0.7187000     -1.3600000E-02
 C    2.826100      -1.029200     -0.3476000    
 C    2.951700      0.3178000      0.3557000    
 C    1.515900      -1.726800      2.6400000E-02
 C    1.785500       1.241200     -5.5000000E-03
 C   0.3268000     -0.8028000      1.9800000E-02
 C   0.4580000      0.5368000     -9.4999997E-03
 C  -0.7967000       1.375200     -3.8500000E-02
 C   -2.043200     -0.5827000      2.1299999E-02
 C   -3.380400      -1.274500      4.2300001E-02
 H    3.673700      -1.672000     -8.4299996E-02
 H    2.865900     -0.8782000      -1.433900    
 H    3.899100      0.7977000      8.5299999E-02
 H    2.973100      0.1603000       1.441800    
 H    1.610600      -2.163700       1.028500    
 H    1.352500      -2.557100     -0.6714000    
 H    1.956000       1.666500      -1.002300    
 H    1.772500       2.076300      0.7047000    
 H  -0.9793000      -2.385500      5.8100000E-02
 H   -4.194200     -0.5451000      7.8100003E-02
 H   -3.441600      -1.922600      0.9211000    
 H   -3.485700      -1.884900     -0.8591000    


%chk=000063131-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000063131

0 1
O -0.699674 2.677220 -0.087882
N -0.928193 -1.377203 0.034142
N -2.029936 0.739609 -0.010485
C 2.841824 -1.037132 -0.367831
C 2.971767 0.316966 0.367440
C 1.535558 -1.756467 0.043802
C 1.809731 1.264599 -0.005714
C 0.354515 -0.805873 0.022490
C 0.463607 0.570182 -0.002599
C -0.758924 1.410639 -0.037609
C -2.076299 -0.581201 0.021328
C -3.402070 -1.307753 0.038635
H 3.707302 -1.688084 -0.144670
H 2.836823 -0.860976 -1.461184
H 3.938875 0.792609 0.119919
H 2.971443 0.137980 1.461408
H 1.647864 -2.176564 1.065032
H 1.342611 -2.614925 -0.631764
H 1.976343 1.707914 -1.008721
H 1.756677 2.129909 0.680831
H -1.021606 -2.395116 0.045299
H -4.205294 -0.558552 0.067256
H -3.496328 -1.965035 0.923532
H -3.534117 -1.931047 -0.866056


