%chk=000057453.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057453

0 1
 O   -3.565300     -0.6628000      -1.213800    
 N   -1.846400      0.6919000     -0.3315000    
 N   -2.528100      -1.114300      0.8358000    
 C  -0.9659000      0.6520000      0.8333000    
 C   -1.565500     -0.4679000       1.694600    
 C   0.4396000      0.3289000      0.4475000    
 C   -2.744000     -0.3903000     -0.3481000    
 C   -1.762400       1.728500      -1.340700    
 C    1.468900       1.214200      0.7636000    
 C   0.7203000     -0.8580000     -0.2277000    
 C    2.782200      0.9119000      0.4035000    
 C    2.033700      -1.160300     -0.5876000    
 C    3.064500     -0.2754000     -0.2720000    
 C    4.468500     -0.5983000     -0.6570000    
 H   -1.033800       1.612900       1.356600    
 H  -0.8562000      -1.204500       2.083600    
 H   -2.127600     -4.9300000E-02   2.536600    
 H   -3.055000      -1.943200       1.091900    
 H   -2.548200       1.592100      -2.088000    
 H  -0.7868000       1.676800      -1.830600    
 H   -1.883200       2.701300     -0.8572000    
 H    1.264000       2.142700       1.289600    
 H  -6.0500000E-02  -1.565800     -0.4897000    
 H    3.577100       1.608500      0.6565000    
 H    2.241300      -2.089000      -1.112500    
 H    5.044500      0.3128000     -0.8516000    
 H    4.958700      -1.158400      0.1455000    
 H    4.499200      -1.198000      -1.573100    


%chk=000057453-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057453

0 1
O -3.698864 -0.752942 -1.099538
N -1.944794 0.655958 -0.312868
N -2.565520 -1.078038 0.973052
C -0.993208 0.705186 0.815527
C -1.622676 -0.337560 1.822010
C 0.447351 0.374779 0.414237
C -2.834419 -0.425984 -0.238173
C -1.859151 1.524409 -1.479289
C 1.521654 1.159768 0.892412
C 0.738037 -0.736812 -0.418106
C 2.857801 0.838967 0.557900
C 2.070298 -1.053108 -0.751180
C 3.155605 -0.271720 -0.269826
C 4.586549 -0.610119 -0.651588
H -0.997970 1.712688 1.277681
H -0.841893 -0.989970 2.248804
H -2.138083 0.189292 2.650566
H -3.175360 -1.820735 1.303995
H -2.653234 1.215862 -2.180142
H -0.878526 1.433156 -1.985604
H -2.017229 2.585459 -1.204395
H 1.315797 2.029137 1.530733
H -0.084211 -1.348895 -0.807482
H 3.677124 1.460452 0.939271
H 2.276164 -1.916602 -1.396192
H 5.312431 -0.027453 -0.058690
H 4.802884 -1.683005 -0.495437
H 4.777043 -0.393169 -1.720177


