%chk=000022243.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022243

0 1
 O    1.411600      -2.718400     -0.3059000    
 N   -1.314000      -2.833400      0.3293000    
 C  -0.6062000      -1.539400      0.4684000    
 C   0.6179000      -1.543700     -0.5020000    
 C   -1.523800     -0.3767000      0.2916000    
 C    1.533000     -0.3525000     -0.3041000    
 C   -1.311200      0.7962000       1.016000    
 C   -2.594800     -0.4624000     -0.5981000    
 C    1.300000      0.8038000      -1.026700    
 C    2.580300     -0.4492000      0.5944000    
 C   -2.169500       1.883300      0.8507000    
 C   -3.452900      0.6247000     -0.7636000    
 C    2.142800       1.900300     -0.8446000    
 C    3.422900      0.6475000      0.7767000    
 C   -3.240300       1.797600     -3.9200000E-02
 C    3.204100       1.822200      5.7200000E-02
 H  -0.2254000      -1.535900       1.499400    
 H   0.2692000      -1.572300      -1.543100    
 H   -2.007400      -2.919200       1.072100    
 H  -0.6514000      -3.595300      0.4703000    
 H  -0.4864000      0.8767000       1.719300    
 H   -2.777100      -1.354500      -1.190900    
 H   0.4817000      0.8735000      -1.737300    
 H    2.762600      -1.344900       1.180400    
 H    2.096400      -2.732900     -0.9970000    
 H   -2.004600       2.796100       1.415600    
 H   -4.284100      0.5599000      -1.459600    
 H    1.973200       2.814600      -1.405800    
 H    4.246800      0.5884000       1.481900    
 H   -3.907900       2.644400     -0.1685000    
 H    3.859600       2.676400      0.1996000    


%chk=000022243-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022243

0 1
O 1.330555 -2.833350 -0.283480
N -1.309383 -2.876470 0.295478
C -0.575713 -1.620971 0.530418
C 0.586097 -1.569558 -0.510286
C -1.502735 -0.412950 0.379959
C 1.499097 -0.361411 -0.355438
C -1.351851 0.723511 1.211122
C -2.513864 -0.408296 -0.614199
C 1.387671 0.744103 -1.233285
C 2.468983 -0.326053 0.680046
C -2.190298 1.849951 1.050164
C -3.353343 0.716097 -0.777486
C 2.224695 1.872007 -1.077888
C 3.308326 0.799379 0.835160
C -3.193529 1.850673 0.053292
C 3.188120 1.902616 -0.043075
H -0.087307 -1.569625 1.534343
H 0.128333 -1.583030 -1.521552
H -2.102665 -3.019404 0.926970
H -0.682781 -3.685095 0.232751
H -0.572284 0.728615 1.983027
H -2.638572 -1.305003 -1.230886
H 0.635457 0.726789 -2.031337
H 2.564692 -1.188120 1.349567
H 2.118859 -2.847518 -0.882009
H -2.063083 2.722403 1.701230
H -4.134067 0.708066 -1.547183
H 2.126576 2.722788 -1.761435
H 4.055862 0.817685 1.636657
H -3.847193 2.721900 -0.070115
H 3.840447 2.775172 0.075968


