%chk=000177746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177746

0 1
 O   0.1625000      -3.300500     -0.1517000    
 N    1.814700      -1.730100     -0.3491000    
 N   0.2489000      0.8865000     -0.1308000    
 C  -0.5938000      8.0000004E-03  0.3081000    
 C  -0.1594000      -1.246000       1.013900    
 C    2.377900     -0.4426000     -0.2041000    
 C    1.643800      0.7446000     -1.2100000E-02
 C   -2.048000      0.2528000      0.1104000    
 C   0.5940000      -2.175400      0.1048000    
 C    3.781100     -0.3848000     -0.2871000    
 C    2.355800       1.947300      0.1542000    
 C   -2.918000     -0.8248000     -2.6500000E-02
 C   -2.529200       1.558000      6.4199999E-02
 C    4.462800      0.8187000     -0.1183000    
 C    3.749300       1.985600      0.1151000    
 C   -4.281300     -0.5954000     -0.2115000    
 C   -3.892600       1.787300     -0.1207000    
 C   -4.768700      0.7106000     -0.2585000    
 H   0.4867000     -0.9707000       1.857300    
 H  -0.9972000      -1.784200       1.465000    
 H    2.411500      -2.434400     -0.7763000    
 H    4.361200      -1.289700     -0.4580000    
 H    1.813900       2.881900      0.2911000    
 H   -2.570800      -1.853300     -2.6200000E-02
 H   -1.866700       2.412000      0.1769000    
 H    5.547200      0.8419000     -0.1673000    
 H    4.271500       2.929000      0.2434000    
 H   -4.962800      -1.433300     -0.3261000    
 H   -4.272700       2.804200     -0.1560000    
 H   -5.830000      0.8893000     -0.4039000    


%chk=000177746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177746

0 1
O 0.060510 -3.260861 -0.364794
N 1.694385 -1.615635 -0.568330
N 0.256070 0.966820 0.047767
C -0.589839 0.023932 0.413913
C -0.088235 -1.258758 1.078481
C 2.360963 -0.401482 -0.237604
C 1.653776 0.812330 0.086729
C -2.042760 0.226789 0.174608
C 0.535487 -2.151205 0.006401
C 3.779523 -0.382188 -0.331094
C 2.422642 1.990473 0.327975
C -2.966671 -0.853897 0.228249
C -2.525137 1.528113 -0.147139
C 4.509518 0.791486 -0.077152
C 3.824497 1.985613 0.268289
C -4.338064 -0.634333 -0.025896
C -3.894676 1.744693 -0.387946
C -4.808840 0.663746 -0.326900
H 0.689896 -0.981648 1.816379
H -0.880541 -1.819151 1.589566
H 2.168047 -2.246366 -1.223526
H 4.304492 -1.310318 -0.589335
H 1.867345 2.908032 0.546008
H -2.620333 -1.872851 0.430335
H -1.801876 2.347256 -0.200897
H 5.602143 0.779620 -0.146815
H 4.385219 2.904676 0.466957
H -5.037043 -1.477077 0.006825
H -4.254110 2.752340 -0.624376
H -5.874789 0.832353 -0.516480


