%chk=000100692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100692

0 1
 O    1.253900      0.7937000     -0.5934000    
 O   0.7715000     -0.6251000       2.031300    
 O    3.137600      -1.721400       1.155500    
 O    3.747700       1.840000      -1.395700    
 O   -3.764900     -0.9481000      -1.449500    
 O   -1.936100      -1.980700     -0.7955000    
 N  -0.9964000      0.5400000      0.1590000    
 N   -3.151300       1.022000      0.4580000    
 N   -2.680600     -0.9589000     -0.7999000    
 C   0.7999000      -1.151900      0.7079000    
 C    2.229000      -1.209000      0.2048000    
 C   0.2072000     -0.1534000     -0.2839000    
 C    2.501600      0.2556000     -0.1140000    
 C    3.579300      0.4508000      -1.165300    
 C   -2.298200      0.1763000     -7.6099999E-02
 C   -1.031900       1.697400      0.8933000    
 C   -2.368400       1.972800       1.063400    
 H   0.2940000      -2.120800      0.7152000    
 H    2.279700      -1.824500     -0.7014000    
 H  -8.0000004E-03 -0.6329000      -1.244400    
 H    2.770000      0.8248000      0.7851000    
 H    3.300900     -1.2200000E-02  -2.117600    
 H    4.536200      3.5399999E-02 -0.8361000    
 H    1.152500      -1.299200       2.619400    
 H    3.136200      -1.131800       1.928200    
 H  -0.1376000       2.207100       1.223800    
 H   -2.806500       2.806700       1.592100    
 H    2.888700       2.196400      -1.680200    


%chk=000100692-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100692

0 1
O 1.287526 0.528407 -1.116213
O 0.384840 -1.491062 1.541765
O 2.981205 -1.496249 1.453506
O 3.580455 2.291084 -1.128525
O -4.011667 -1.255686 0.303074
O -1.915992 -2.116786 -0.045375
N -0.829578 0.483746 0.009048
N -2.796811 1.231541 0.918531
N -2.743677 -1.120099 0.199718
C 0.830694 -1.488477 0.157426
C 2.361928 -1.150583 0.194603
C 0.199508 -0.343226 -0.716696
C 2.411049 0.359157 -0.125171
C 3.675092 0.863907 -0.807833
C -2.152545 0.178569 0.368636
C -0.647884 1.815104 0.355069
C -1.863321 2.253273 0.918936
H 0.632385 -2.461764 -0.319652
H 2.886043 -1.715602 -0.597332
H -0.278942 -0.738330 -1.626490
H 2.194647 0.954932 0.784108
H 3.875481 0.256874 -1.716023
H 4.527434 0.769304 -0.115783
H -0.460471 -2.006899 1.595057
H 2.245882 -1.531099 2.129303
H 0.280983 2.335720 0.145287
H -2.100543 3.236746 1.316200
H 2.852277 2.406599 -1.791173


