%chk=000127787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127787

0 1
 O    1.735600       2.817600      0.8214000    
 O   -5.087600       2.894800      0.5334000    
 O   -5.370300       2.250000      -1.628000    
 N   -1.209100      -2.067400      0.7474000    
 N    4.517400      0.3163000     -0.6124000    
 N    3.763800       2.538600     -0.2076000    
 N    5.816800       2.096500      -1.247900    
 C  -0.1713000      -1.880200       1.737800    
 C    1.060200      -1.309300       1.118900    
 C    1.226600      7.3700003E-02   1.049400    
 C    2.384600      0.5990000      0.4696000    
 C   -2.108100      -1.041000      0.4321000    
 C    3.376200     -0.2486000     -4.0600002E-02
 C    2.043300      -2.160600      0.6133000    
 C   -1.295500      -3.357100      6.3299999E-02
 C    3.198800      -1.632500      3.4800000E-02
 C   -2.646500     -0.9432000     -0.8565000    
 C   -2.478400     -0.1021000       1.402100    
 C    2.600400       2.069400      0.3761000    
 C   -3.542000      7.9099998E-02  -1.170600    
 C   -3.373900      0.9201000       1.087900    
 C    4.645300       1.686100     -0.6627000    
 C   -3.905700       1.010700     -0.1985000    
 C  -0.4970000      -3.345500      -1.164800    
 C   -4.840000       2.076000     -0.5257000    
 C   0.1566000      -3.340400      -2.172000    
 H   8.1900001E-02  -2.846100       2.197300    
 H  -0.4730000      -1.278600       2.600700    
 H   0.4616000      0.7331000       1.449300    
 H    1.929800      -3.239800      0.6726000    
 H  -0.9315000      -4.156300      0.7207000    
 H   -2.339200      -3.617000     -0.1531000    
 H    3.957000      -2.308000     -0.3531000    
 H   -2.395400      -1.637600      -1.650200    
 H   -2.120300     -0.1442000       2.424900    
 H    5.233700     -0.2976000     -0.9805000    
 H   -3.944800      0.1334000      -2.178700    
 H   -3.635600       1.620300       1.876400    
 H    6.036400       3.081600      -1.347700    
 H    6.495600       1.429400      -1.598100    
 H   0.7376000      -3.334300      -3.064300    
 H   -5.718900       3.609200      0.3025000    


%chk=000127787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127787

0 1
O 3.678374 1.549674 3.213347
O -4.651757 3.085077 -0.800172
O -5.856823 1.517778 -2.020211
N -1.257330 -2.144800 0.859006
N 4.270861 1.016504 -0.812115
N 4.913152 2.029500 1.282398
N 6.120033 2.485248 -0.658897
C -0.118220 -1.760599 1.714038
C 1.020523 -1.012401 1.010926
C 1.869647 -0.175053 1.761335
C 2.958021 0.497396 1.160080
C -2.123147 -1.177284 0.325811
C 3.186329 0.325540 -0.233379
C 1.268342 -1.172190 -0.379058
C -1.490078 -3.579852 0.596902
C 2.340150 -0.509808 -1.002888
C -3.177991 -1.541263 -0.572810
C -1.985762 0.205307 0.674086
C 3.859172 1.386225 1.970373
C -4.065461 -0.574236 -1.064279
C -2.879797 1.163374 0.175448
C 5.079585 1.837529 -0.023652
C -3.937840 0.791366 -0.696030
C -1.001983 -4.065765 -0.717671
C -4.898946 1.767240 -1.242104
C -0.599889 -4.480658 -1.806640
H 0.288407 -2.691864 2.151424
H -0.475292 -1.151414 2.569505
H 1.720616 -0.010786 2.835907
H 0.608898 -1.813657 -0.972879
H -0.992301 -4.160267 1.394916
H -2.571862 -3.802729 0.682522
H 2.513883 -0.635941 -2.078432
H -3.289431 -2.574593 -0.911374
H -1.174563 0.534363 1.327614
H 4.446537 0.906363 -1.811996
H -4.870558 -0.857850 -1.750504
H -2.766915 2.214480 0.455851
H 6.699231 3.080778 -0.071210
H 6.312393 2.412262 -1.654181
H -0.253950 -4.844294 -2.757502
H -5.339160 3.678799 -1.204606


