%chk=000164370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164370

0 1
 O   0.8862000      -1.221300     -0.5617000    
 O   -4.925200      0.9639000      0.4787000    
 N    2.609400      -1.815800      0.8386000    
 N    4.412500     -0.2758000       1.258900    
 N    4.465100       1.822000      0.2798000    
 C  -0.9358000      -2.730800      -1.027300    
 C   -2.003300      -1.742600     -0.6242000    
 C   0.3700000      -2.514400     -0.2703000    
 C   -2.858600      -2.054300      0.4208000    
 C   -2.108200     -0.5410000      -1.306500    
 C   -3.962400      7.2999999E-02  0.1156000    
 C   -3.844600      -1.140600      0.7931000    
 C   -3.094000      0.3728000     -0.9341000    
 C    2.070100     -0.8805000      3.9099999E-02
 C    2.647500      0.3660000     -0.1902000    
 C    3.857500      0.6409000      0.4580000    
 C    2.070900       1.331300      -1.028600    
 C   -4.639500       2.347100      0.2765000    
 C    2.705100       2.548200      -1.206900    
 C    3.766200      -1.451000       1.409200    
 C    3.892800       2.741900     -0.5339000    
 C   -5.381700       3.160800       1.315200    
 H  -0.7569000      -2.638600      -2.106400    
 H   -1.296200      -3.753600     -0.8623000    
 H    1.085700      -3.282400     -0.5895000    
 H   0.1907000      -2.613500      0.8081000    
 H   -2.773100      -2.995900      0.9556000    
 H   -1.441100     -0.3002000      -2.129200    
 H   -4.517700      -1.379400       1.611900    
 H   -3.169100       1.293600      -1.504900    
 H    1.132400       1.145800      -1.544300    
 H   -3.570100       2.564200      0.3916000    
 H   -4.967500       2.639400     -0.7271000    
 H    2.286300       3.314900      -1.847300    
 H    4.235100      -2.176800       2.062400    
 H    4.441100       3.673300     -0.6299000    
 H   -5.193500       4.230000       1.183000    
 H   -6.459800       2.981300       1.247300    
 H   -5.074000       2.870000       2.325200    


%chk=000164370-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164370

0 1
O 1.041278 -1.301781 -0.637806
O -4.805827 1.111128 0.967599
N 2.789936 -1.966995 0.801502
N 4.679379 -0.469342 1.243809
N 4.782901 1.679298 0.251172
C -0.938591 -2.622582 -1.140237
C -1.964276 -1.622515 -0.625750
C 0.383808 -2.614519 -0.359738
C -2.748005 -1.915196 0.523440
C -2.152705 -0.369968 -1.253563
C -3.850869 0.261745 0.387048
C -3.679166 -0.990706 1.029305
C -3.084464 0.574281 -0.763350
C 2.231727 -1.047023 -0.002718
C 2.836906 0.242259 -0.249504
C 4.098979 0.487852 0.411496
C 2.273211 1.254122 -1.079076
C -5.022466 2.431269 0.343743
C 2.973876 2.454402 -1.230100
C 3.998622 -1.616663 1.388019
C 4.221632 2.612574 -0.546934
C -6.092537 3.139539 1.170121
H -0.716215 -2.439067 -2.207608
H -1.341022 -3.652568 -1.068762
H 1.067460 -3.418382 -0.687476
H 0.232346 -2.705049 0.730316
H -2.632857 -2.883608 1.027008
H -1.560959 -0.122397 -2.143265
H -4.286560 -1.214297 1.911730
H -3.202547 1.531461 -1.280013
H 1.312896 1.072908 -1.570737
H -4.069957 3.000819 0.344995
H -5.350787 2.293527 -0.707411
H 2.589951 3.267235 -1.853787
H 4.438058 -2.376365 2.041745
H 4.788348 3.545506 -0.654967
H -6.299239 4.139738 0.747709
H -7.030674 2.558915 1.171390
H -5.759289 3.262342 2.214656


