%chk=000021236.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021236

0 1
 O   -1.205800       1.722300      0.7364000    
 O   -2.177900      0.8179000      -1.101900    
 N   -2.093200      -1.652200      0.1158000    
 C   0.2734000      -1.047500     -5.8200002E-02
 C    1.362800     -1.3000000E-02  0.2455000    
 C   -1.095300     -0.6548000      0.5103000    
 C    2.703900     -0.4256000     -0.3632000    
 C    3.797500      0.5778000     -3.3500001E-02
 C   -1.565300      0.6751000     -5.1100001E-02
 H   0.5744000      -2.020900      0.3501000    
 H   0.2041000      -1.167400      -1.148000    
 H    1.089700      0.9651000     -0.1647000    
 H    1.465500      0.1027000       1.331100    
 H   -1.072200     -0.5962000       1.603800    
 H    2.996900      -1.411700      1.5600000E-02
 H    2.608800     -0.5111000      -1.452000    
 H    3.551200       1.569700     -0.4258000    
 H    4.747000      0.2631000     -0.4776000    
 H    3.939900      0.6616000       1.048600    
 H   -1.824200      -2.564100      0.4844000    
 H   -2.099600      -1.754800     -0.8988000    
 H   -1.500200       2.579600      0.3612000    


%chk=000021236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021236

0 1
O -1.338632 1.710594 0.773223
O -2.271869 0.767037 -1.130049
N -2.129873 -1.716631 0.217670
C 0.292305 -0.989366 -0.156006
C 1.413172 0.014291 0.195069
C -1.107210 -0.690965 0.487586
C 2.796009 -0.434994 -0.332009
C 3.918418 0.572040 -0.000891
C -1.646278 0.627806 -0.054904
H 0.587428 -2.000432 0.194058
H 0.163420 -1.056026 -1.255283
H 1.173605 1.013335 -0.219778
H 1.463954 0.144591 1.295893
H -0.971804 -0.579561 1.578544
H 3.046423 -1.425879 0.099196
H 2.738953 -0.579205 -1.430322
H 3.706083 1.562153 -0.446557
H 4.896166 0.230430 -0.387384
H 4.016442 0.711497 1.092204
H -1.844964 -2.666663 0.469580
H -2.534565 -1.647178 -0.722031
H -1.685783 2.548724 0.360188


