%chk=000140515.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140515

0 1
 O    5.151100      -1.137100      5.1600002E-02
 O   -4.471000      -2.046800     -0.3424000    
 O   -1.519700       2.810000      4.5000002E-02
 N  -0.1480000       2.522000      7.5300001E-02
 C    1.386800      0.6113000      2.3900000E-02
 C   -1.155000      0.3413000     -8.3499998E-02
 C   6.7400001E-02   1.223500      1.2800000E-02
 C    1.512000     -0.7756000     -5.3900000E-02
 C   -1.716700     -0.1043000       1.081100    
 C    2.526500       1.410800      0.1117000    
 C   -1.631700      3.8400002E-02  -1.329200    
 C    3.916800     -0.5640000      4.3800000E-02
 C   -3.368100      -1.254000     -0.2562000    
 C    2.777000      -1.363300     -4.4000000E-02
 C   -2.846000     -0.9184000      0.9929000    
 C    3.791600      0.8230000      0.1215000    
 C   -2.761000     -0.7756000      -1.417300    
 C    5.206800      -2.560400     -3.2600001E-02
 C   -5.042700      -2.499500      0.8841000    
 C   -1.676100       4.218700      0.1153000    
 H   0.6585000      -1.442400     -0.1238000    
 H   -1.311100      0.1574000       2.053000    
 H    2.456900       2.493500      0.1733000    
 H   -1.160600      0.4106000      -2.233000    
 H    2.802700      -2.445900     -0.1074000    
 H   -3.267500      -1.254700       1.934100    
 H    4.676000       1.450600      0.1895000    
 H   -3.163300      -1.033300      -2.393200    
 H    4.795400      -2.923800     -0.9804000    
 H    4.733300      -3.033600      0.8343000    
 H    6.264300      -2.844100     -1.3600000E-02
 H   -5.412100      -1.664100       1.488400    
 H   -4.348400      -3.138900       1.439700    
 H   -5.910200      -3.116600      0.6279000    
 H   -1.194000       4.698500     -0.7420000    
 H   -1.253700       4.602500       1.049100    
 H   -2.744300       4.450100      9.2100002E-02


%chk=000140515-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000140515

0 1
O 5.266285 -1.045352 0.035745
O -4.640543 -2.163361 -0.361976
O -1.442986 3.011413 0.047494
N -0.063010 2.536145 0.058739
C 1.351048 0.605309 0.017275
C -1.219920 0.327836 -0.054696
C -0.005927 1.210902 0.009762
C 1.514546 -0.802732 -0.049276
C -1.820917 -0.164560 1.126186
C 2.527455 1.414898 0.088434
C -1.788731 -0.027784 -1.306420
C 3.945224 -0.575689 0.025132
C -3.513791 -1.344371 -0.182091
C 2.795363 -1.397953 -0.045884
C -2.962312 -0.997602 1.076056
C 3.802618 0.836811 0.092543
C -2.922654 -0.856631 -1.374951
C 5.469892 -2.494526 -0.031815
C -5.300781 -2.677801 0.839591
C -1.408615 4.481331 0.096443
H 0.629490 -1.444717 -0.105662
H -1.397832 0.107104 2.099685
H 2.415395 2.501710 0.139453
H -1.340494 0.351683 -2.231000
H 2.879922 -2.487449 -0.099086
H -3.404476 -1.359295 2.009117
H 4.707139 1.450538 0.146724
H -3.369060 -1.135249 -2.334323
H 5.058322 -2.915187 -0.969890
H 5.011222 -3.005828 0.836837
H 6.560768 -2.632881 -0.010346
H -5.681187 -1.853995 1.474745
H -4.618748 -3.317983 1.432955
H -6.143824 -3.279227 0.468881
H -0.882910 4.892384 -0.784160
H -0.915972 4.832921 1.020875
H -2.468103 4.784987 0.086802


