%chk=000099755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099755

0 1
 O    4.589100     -0.7145000     -0.9384000    
 O    4.580100     -0.1986000       1.195300    
 N   -3.637000      0.2315000     -4.2900000E-02
 N   -1.411100       1.132600     -0.2816000    
 N    3.998000     -0.3014000      8.8500001E-02
 C   -3.092500      -2.020600      8.4200002E-02
 C   -4.225700      -1.031800      0.3646000    
 C   -1.805900      -1.217400      0.2850000    
 C   -2.259300      0.1858000     -5.6299999E-02
 C   -4.440800       1.426300     -0.1159000    
 C  -5.5300001E-02  0.7733000     -0.1889000    
 C   0.6155000      0.3129000      -1.317400    
 C   0.6053000      0.8806000       1.031000    
 C    1.960700     -4.4000000E-02  -1.225200    
 C    1.950600      0.5237000       1.123200    
 C    2.628400      6.1500002E-02 -5.1000002E-03
 H   -3.151900      -2.357400     -0.9587000    
 H   -3.141600      -2.905900      0.7247000    
 H   -5.124600      -1.278900     -0.2083000    
 H   -4.469300      -1.007900       1.432300    
 H   -1.022300      -1.614100     -0.3620000    
 H   -1.489300      -1.253800       1.332600    
 H   -5.464800       1.192300     -0.4246000    
 H   -4.027000       2.131100     -0.8443000    
 H   -4.478400       1.918300      0.8610000    
 H   0.1030000      0.2287000      -2.272000    
 H   8.4600002E-02   1.240400       1.914400    
 H    2.456500     -0.3999000      -2.124700    
 H    2.438300      0.6190000       2.090000    


%chk=000099755-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099755

0 1
O 4.991532 0.451514 -1.095923
O 4.812156 -0.124634 1.108179
N -3.640770 0.155735 -0.031855
N -1.371856 0.619266 -0.464256
N 4.289599 0.203188 -0.033658
C -3.609944 -2.134630 0.594315
C -4.527718 -0.884116 0.529363
C -2.182857 -1.539234 0.724802
C -2.297772 -0.164601 0.047626
C -4.146800 1.425400 -0.548795
C 0.005825 0.459967 -0.316205
C 0.836927 0.739925 -1.448270
C 0.643805 0.121511 0.923156
C 2.232021 0.651311 -1.364745
C 2.040614 0.040234 1.018371
C 2.829191 0.295795 -0.129008
H -3.695194 -2.710144 -0.343650
H -3.872969 -2.800743 1.431727
H -5.407535 -1.033517 -0.123196
H -4.896107 -0.586517 1.533735
H -1.398473 -2.154058 0.254247
H -1.905806 -1.407874 1.787585
H -4.907219 1.251502 -1.333171
H -3.295783 1.977347 -0.978931
H -4.602992 2.035987 0.255079
H 0.347860 1.024397 -2.384583
H 0.032250 -0.041403 1.816751
H 2.873253 0.852225 -2.227003
H 2.538062 -0.212034 1.958815


