%chk=000174482.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174482

0 1
 O    4.886400      5.9500001E-02 -2.6799999E-02
 O   -7.851300     -0.6682000      0.1688000    
 O   -2.351200       2.381800     -0.1868000    
 O    8.318600      0.7284000     -7.1199998E-02
 O    6.573000       2.046600     -0.2568000    
 N   -1.584300      0.2031000     -3.0600000E-02
 N    7.062700      0.8884000     -0.1056000    
 N  -0.2869000      0.5897000     -7.0400000E-02
 C   -3.966200      0.6864000     -2.4700001E-02
 C   -4.940500       1.526800      0.4722000    
 C   -4.248000     -0.5919000     -0.4592000    
 C   -6.567700     -0.2206000      0.1046000    
 C   -6.256200       1.068200      0.5375000    
 C   -5.563700      -1.050700     -0.3939000    
 C    4.259100      -1.126000      0.1144000    
 C   -2.564700       1.175500     -9.4899997E-02
 C    5.141900      -2.155900      0.2539000    
 C    6.216300     -0.2144000      2.3100000E-02
 C    6.425700      -1.563100      0.1946000    
 C    2.828600      -1.219500      0.1098000    
 C    2.014900     -0.1602000      4.1000000E-03
 C   0.5534000     -0.3879000      2.8300000E-02
 C   -8.099900      -1.996000     -0.2905000    
 H   -4.713500       2.530900      0.8179000    
 H   -3.501500      -1.255300     -0.8834000    
 H   -7.034000       1.718900      0.9279000    
 H   -5.737500      -2.059200     -0.7534000    
 H    4.912200      -3.204400      0.3828000    
 H    7.381200      -2.063000      0.2685000    
 H    2.405200      -2.216700      0.2083000    
 H   -1.772200     -0.7850000      0.1022000    
 H    2.371300      0.8587000     -9.3199998E-02
 H   0.2258000      -1.438900      0.1337000    
 H   -7.879300      -2.100300      -1.358300    
 H   -9.170900      -2.186100     -0.1654000    
 H   -7.570600      -2.737800      0.3171000    


%chk=000174482-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174482

0 1
O 4.904018 0.083099 -0.057556
O -8.050059 -0.437770 0.034917
O -2.204444 2.269846 0.099152
O 8.357021 1.022330 -0.306339
O 6.441027 2.294287 -0.451153
N -1.549856 0.013086 0.136053
N 7.063054 1.171281 -0.292428
N -0.213854 0.304071 0.065243
C -3.939539 0.571381 0.048878
C -4.948349 1.482130 0.473432
C -4.334788 -0.708593 -0.418277
C -6.679892 -0.174881 0.006311
C -6.300136 1.116903 0.460361
C -5.693081 -1.089216 -0.444035
C 4.421904 -1.229818 0.162031
C -2.522130 1.053375 0.083411
C 5.518128 -2.108111 0.267116
C 6.299781 -0.020563 -0.082559
C 6.710465 -1.338062 0.111538
C 3.004958 -1.441308 0.236314
C 2.051614 -0.448947 0.113902
C 0.636949 -0.708504 0.195306
C -8.509485 -1.750361 -0.434691
H -4.639217 2.478484 0.804770
H -3.596320 -1.413916 -0.819349
H -7.082715 1.806168 0.790293
H -5.969209 -2.076449 -0.825153
H 5.452362 -3.180875 0.437137
H 7.742094 -1.678544 0.134201
H 2.699323 -2.481784 0.404518
H -1.871437 -0.954296 0.296844
H 2.353326 0.591876 -0.052233
H 0.301459 -1.753171 0.363326
H -8.252272 -1.906074 -1.499803
H -9.602091 -1.728754 -0.315804
H -8.082407 -2.566521 0.178924


