%chk=000014141.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014141

0 1
 O    3.074700      -1.099200     -8.3400004E-02
 O    1.172800       1.787100      0.6016000    
 N  -0.7912000     -0.1007000      0.5845000    
 N   0.5378000     -0.4086000      0.3424000    
 N    4.438100      -1.278000     -0.2841000    
 C   -1.611500     -0.5055000     -0.5585000    
 C   -3.065100     -0.2628000     -0.3288000    
 C   -3.855000      -1.256100      0.2502000    
 C   -3.634600      0.9575000     -0.6926000    
 C    2.869400      0.2026000      0.1304000    
 C    1.478400      0.6156000      0.3698000    
 C   -5.214400      -1.029300      0.4651000    
 C   -4.994100       1.184300     -0.4774000    
 C    3.994700      0.9244000      9.0000004E-02
 C    4.966500     -5.5700000E-02 -0.1759000    
 C   -5.783900      0.1908000      0.1015000    
 C    6.417400      0.1335000     -0.3349000    
 H   -1.455400      -1.569800     -0.7828000    
 H   -1.291500      3.9299998E-02  -1.457000    
 H   -1.067000     -0.6370000       1.407000    
 H   -3.423300      -2.210500      0.5399000    
 H   -3.030100       1.740400      -1.142800    
 H   0.7905000      -1.378100      0.1763000    
 H    4.124900       1.987600      0.2266000    
 H   -5.829300      -1.802400      0.9163000    
 H   -5.437600       2.134500     -0.7601000    
 H   -6.842300      0.3676000      0.2693000    
 H    6.697300       1.185700     -0.2190000    
 H    6.967900     -0.4440000      0.4150000    
 H    6.743900     -0.1923000      -1.327900    


%chk=000014141-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014141

0 1
O 3.190167 -1.083678 0.373511
O 1.014579 1.812691 -0.094177
N -0.826192 -0.233452 0.705933
N 0.561286 -0.405267 0.600519
N 4.648614 -1.207744 0.200006
C -1.650706 -0.929041 -0.310094
C -3.100691 -0.473818 -0.206417
C -4.158025 -1.415875 -0.217252
C -3.405372 0.909706 -0.121243
C 2.823612 0.240849 0.084176
C 1.384971 0.639011 0.181821
C -5.504111 -0.985241 -0.158094
C -4.748611 1.339492 -0.056772
C 3.952053 0.962325 -0.259825
C 5.051860 0.034846 -0.175815
C -5.802359 0.394107 -0.078019
C 6.510523 0.294337 -0.447846
H -1.598462 -2.041156 -0.229512
H -1.233427 -0.654422 -1.297698
H -1.169273 -0.298540 1.670992
H -3.930400 -2.487808 -0.274741
H -2.579852 1.629797 -0.098768
H 0.993510 -1.329030 0.752218
H 3.987168 2.012475 -0.535216
H -6.314819 -1.722509 -0.169922
H -4.975174 2.409821 0.007194
H -6.844479 0.729709 -0.029544
H 6.668180 1.346611 -0.732741
H 7.123351 0.079698 0.444652
H 6.880076 -0.346996 -1.266624


