%chk=000026834.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026834

0 1
 O    4.866900       1.632600      0.5841000    
 O   9.8800004E-02  -1.585400       1.172000    
 N    2.780000     -7.6600000E-02 -0.3242000    
 N   -1.241300      -1.242100       1.303700    
 C    2.002100      -1.312600     -0.2714000    
 C    4.190600     -0.3603000     -0.6232000    
 C    2.672500      0.6621000      0.9416000    
 C    4.984500      0.9425000     -0.6605000    
 C    3.501400       1.941000      0.8665000    
 C   0.5435000      -1.037400      3.6300000E-02
 C    2.169000      -2.085000      -1.582000    
 C  -0.3991000     -0.3460000     -0.6132000    
 C   -1.515900     -0.5020000      0.2258000    
 C   -2.833400      3.8300000E-02  2.1600001E-02
 C   -2.992900       1.238800     -0.6680000    
 C   -3.946600     -0.6402000      0.5141000    
 C   -4.270300       1.762900     -0.8657000    
 C   -5.224100     -0.1161000      0.3161000    
 C   -5.385800       1.085400     -0.3737000    
 H    2.389200      -1.959100      0.5306000    
 H    4.322000     -0.8202000      -1.606900    
 H    4.618900      -1.028500      0.1351000    
 H    3.034000      4.5100000E-02   1.775000    
 H    1.642100      0.9597000       1.161400    
 H    6.045900      0.7285000     -0.8222000    
 H    4.650700       1.597400      -1.474700    
 H    3.116000       2.629500      0.1045000    
 H    3.471300       2.462100       1.828800    
 H    1.433400      -2.897100      -1.641200    
 H    3.151000      -2.560800      -1.669100    
 H    2.004600      -1.446600      -2.458400    
 H  -0.3101000      0.1869000      -1.548600    
 H   -2.142500       1.794800      -1.054500    
 H   -3.853200      -1.582600       1.048200    
 H   -4.396600       2.699500      -1.400800    
 H   -6.093200     -0.6441000      0.6974000    
 H   -6.380500       1.493600     -0.5277000    


%chk=000026834-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026834

0 1
O 4.815657 1.880836 0.417621
O -0.058179 -2.146023 0.849793
N 2.806699 -0.135631 -0.235636
N -1.478801 -1.788076 0.885164
C 2.096016 -1.446808 -0.147867
C 4.201471 -0.233218 -0.747039
C 2.810331 0.573859 1.077651
C 4.809786 1.173997 -0.871438
C 3.437979 1.967593 0.928396
C 0.622485 -1.196451 0.074553
C 2.266929 -2.314774 -1.422168
C -0.276341 -0.252708 -0.381255
C -1.565869 -0.650025 0.138474
C -2.874331 0.010498 -0.048187
C -2.973651 1.230252 -0.768991
C -4.056047 -0.567612 0.493438
C -4.224890 1.859140 -0.944550
C -5.303490 0.062505 0.316444
C -5.394715 1.278594 -0.403086
H 2.465676 -2.047362 0.722799
H 4.200092 -0.699042 -1.746908
H 4.845045 -0.852867 -0.072961
H 3.383182 -0.006525 1.843377
H 1.770643 0.677240 1.437018
H 5.865846 1.118327 -1.183505
H 4.230205 1.760004 -1.617809
H 2.820319 2.582966 0.238772
H 3.515607 2.472045 1.905482
H 1.589352 -3.183509 -1.364473
H 3.296587 -2.698855 -1.519534
H 2.008977 -1.731794 -2.323923
H -0.036636 0.602565 -1.005341
H -2.075230 1.693340 -1.191459
H -3.978752 -1.508348 1.047847
H -4.286774 2.800312 -1.501842
H -6.206317 -0.393243 0.737676
H -6.365959 1.766802 -0.539735


