%chk=000125582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125582

0 1
 O    1.102500      4.8599999E-02 -0.5467000    
 O    2.779400      -2.259400     -0.4843000    
 O    2.764800       2.339900     -0.1834000    
 O   0.7863000     -0.1785000       1.722900    
 N    2.462200      3.7200000E-02 -0.3018000    
 N   -2.832200      9.6799999E-02  -1.367500    
 N   -5.108200      2.3000001E-03 -0.6697000    
 N   -6.059700      0.1763000      0.3030000    
 C    4.592700     -0.7454000      4.3499999E-02
 C    4.587800      0.7815000      0.1435000    
 C    3.173200      -1.120400     -0.2867000    
 C    3.165900       1.187500     -0.1358000    
 C   -1.106700     -5.0799999E-02  0.2793000    
 C   0.3455000     -6.7699999E-02  0.5891000    
 C   -2.024200     -0.1633000       1.295900    
 C   -1.526400      7.5400002E-02  -1.017600    
 C   -3.377100     -0.1455000      0.9754000    
 C   -3.725800     -1.4600000E-02 -0.3591000    
 H    4.886300      -1.204800      0.9918000    
 H    5.261300      -1.088900     -0.7511000    
 H    5.254100       1.229900     -0.5992000    
 H    4.878700       1.115200       1.143700    
 H   -1.724800     -0.2670000       2.334300    
 H  -0.8539000      0.1680000      -1.862900    
 H   -4.097900     -0.2439000       1.779800    
 H   -5.362500      0.1329000      -1.641400    
 H   -6.931500     -0.2446000     -1.5200000E-02
 H   -6.248600       1.173100      0.4011000    


%chk=000125582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125582

0 1
O 1.124622 0.079562 -0.627498
O 2.731349 -2.326213 -0.459429
O 2.806315 2.370754 -0.053391
O 0.860283 -0.128622 1.722404
N 2.512585 0.034584 -0.353140
N -2.916808 0.187505 -1.355453
N -5.142264 0.153438 -0.721524
N -6.199239 0.086641 0.189838
C 4.676292 -0.811419 0.017460
C 4.700949 0.735688 0.150058
C 3.224189 -1.194433 -0.289211
C 3.262257 1.211394 -0.081707
C -1.106643 0.023712 0.277221
C 0.318967 -0.022539 0.609523
C -2.060088 -0.058284 1.336977
C -1.598361 0.146056 -1.052908
C -3.427256 -0.018287 1.050298
C -3.818039 0.106060 -0.317976
H 4.983453 -1.326014 0.943409
H 5.322047 -1.185454 -0.795187
H 5.359638 1.221881 -0.589556
H 5.022903 1.075096 1.148913
H -1.701938 -0.152313 2.367297
H -0.906248 0.213149 -1.897014
H -4.195231 -0.077292 1.823707
H -5.295471 0.247153 -1.733180
H -6.748638 -0.775401 0.159746
H -6.728425 0.953398 0.311224


