%chk=000028508.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028508

0 1
 O   0.8674000      0.8800000      3.9099999E-02
 N   -1.936000      -2.722800     -6.3999998E-03
 N   -4.602700       3.433800     -4.8000002E-03
 C   -1.774800     -0.4978000      5.9000002E-03
 C  -0.4672000      -1.058800      1.6500000E-02
 C   -2.677800      -1.563100     -8.2999999E-03
 C   0.7922000     -0.3701000      3.1399999E-02
 C    2.114200      -1.167700      3.9500002E-02
 C  -0.5991000      -2.428300      8.6000003E-03
 C   -2.278600      0.8182000      7.0000002E-03
 C    3.361400     -0.3190000      1.2400000E-02
 C   -4.064800      -1.377500     -2.1700000E-02
 C   -3.663700       1.019100     -6.0000001E-03
 C   -4.541200     -6.3299999E-02 -2.0199999E-02
 C    3.914900      3.7700001E-02  -1.207600    
 C    3.932100      8.9800000E-02   1.207900    
 C    5.067800      0.8224000      -1.232800    
 C    5.085000      0.8747000       1.182600    
 C    5.652800       1.241000     -3.7799999E-02
 C   -4.182000       2.351700     -5.4000001E-03
 H    2.126700      -1.802000      0.9348000    
 H    2.117800      -1.838300     -0.8290000    
 H   0.1284000      -3.228300      1.2500000E-02
 H   -2.323200      -3.656300     -1.4800000E-02
 H   -1.601900       1.668500      1.7899999E-02
 H   -4.748600      -2.219500     -3.2699998E-02
 H   -5.617400      9.8999999E-02 -3.0500000E-02
 H    3.465300     -0.2812000      -2.143500    
 H    3.496000     -0.1883000       2.163000    
 H    5.509500       1.108300      -2.182900    
 H    5.540200       1.201300       2.113000    
 H    6.550200       1.852400     -5.7500001E-02


%chk=000028508-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028508

0 1
O 0.318640 0.196089 -2.615969
N -0.892604 -1.396412 1.584326
N -5.465646 1.918561 -2.217906
C -1.522806 -0.299921 -0.318725
C -0.128080 -0.713264 -0.454700
C -1.974966 -0.745540 0.970225
C 0.737819 -0.474465 -1.619733
C 2.162204 -1.065444 -1.639860
C 0.208369 -1.377334 0.737014
C -2.415906 0.395392 -1.164912
C 3.096561 -0.511849 -0.565854
C -3.286561 -0.519381 1.439040
C -3.736514 0.627896 -0.702790
C -4.164404 0.173289 0.588973
C 3.227789 0.888813 -0.378042
C 3.869232 -1.381971 0.244664
C 4.106537 1.404487 0.599409
C 4.752722 -0.868299 1.222313
C 4.872108 0.528375 1.404921
C -4.676519 1.333775 -1.534819
H 2.098279 -2.167049 -1.546979
H 2.561019 -0.841042 -2.646189
H 1.161137 -1.805695 1.040819
H -0.906028 -1.805028 2.517446
H -2.084181 0.742143 -2.146165
H -3.618777 -0.864340 2.423434
H -5.191752 0.374033 0.907579
H 2.641160 1.573943 -1.001984
H 3.792324 -2.467403 0.098324
H 4.197011 2.488627 0.731376
H 5.348674 -1.555234 1.834086
H 5.556058 0.929848 2.160878


