%chk=000128614.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128614

0 1
 O  -7.5599998E-02   1.383600      0.9199000    
 O    2.250200       1.902600       2.410400    
 O    3.992000      0.7832000      -1.416200    
 N    2.639900     -0.4819000     -0.3948000    
 N    3.863300     -0.3142000     -0.8606000    
 C    2.496900     -2.2000000E-03  0.9731000    
 C    2.319300       1.516700       1.034700    
 C    2.157100      -1.870100     -0.4895000    
 C    1.059000       2.006700      0.3251000    
 C    2.948700      -2.771100      0.4542000    
 C    2.273700      -2.350900      -1.932400    
 C   -1.161900       1.181800      0.1167000    
 C   -2.036500      0.1035000      0.3275000    
 C   -3.148100     -6.4099997E-02 -0.5322000    
 C   -1.379700       2.081900     -0.9269000    
 C   -1.832600     -0.8121000       1.372800    
 C   -3.352500      0.8517000      -1.577300    
 C   -2.473100       1.917300      -1.772100    
 C   -4.023100      -1.142200     -0.3214000    
 C   -2.711800      -1.877700       1.567300    
 C   -3.805000      -2.042500      0.7217000    
 H    1.622100     -0.4493000       1.466800    
 H    3.348700     -0.2872000       1.609500    
 H    3.194500       2.027900      0.6200000    
 H    1.094200      -1.904600     -0.2170000    
 H    1.151500       1.777600     -0.7437000    
 H   0.9627000       3.090700      0.4593000    
 H    2.627100      -3.811700      0.3253000    
 H    4.027000      -2.750300      0.2612000    
 H    2.783000      -2.531300       1.509200    
 H    1.766500      -1.666500      -2.622300    
 H    1.791300      -3.329600      -2.039100    
 H    3.311200      -2.471300      -2.263800    
 H    2.165200       2.870800       2.439900    
 H  -0.7470000       2.947300      -1.099800    
 H  -0.9882000     -0.7124000       2.051200    
 H   -4.201400      0.7435000      -2.249100    
 H   -2.647700       2.622600      -2.579500    
 H   -4.884100      -1.290400     -0.9699000    
 H   -2.542600      -2.579200       2.379100    
 H   -4.489100      -2.872300      0.8737000    


%chk=000128614-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128614

0 1
O 0.121395 0.824861 0.537829
O 2.011678 1.939704 2.535240
O 4.931805 0.783971 -0.323477
N 3.098112 -0.482272 -0.080012
N 4.207017 -0.163953 -0.829331
C 2.851399 0.151385 1.233456
C 2.347887 1.610766 1.141320
C 2.258619 -1.631703 -0.545728
C 1.163199 1.794869 0.184789
C 2.676843 -2.928951 0.188411
C 2.315262 -1.796468 -2.076397
C -1.068101 0.836069 -0.208439
C -2.067801 -0.104771 0.238122
C -3.315149 -0.181883 -0.491598
C -1.300711 1.668851 -1.309843
C -1.861296 -0.950259 1.375304
C -3.530427 0.678284 -1.620970
C -2.544012 1.582301 -2.012085
C -4.306818 -1.121948 -0.055556
C -2.849900 -1.854716 1.774315
C -4.080938 -1.943865 1.051349
H 2.095389 -0.442256 1.770110
H 3.793200 0.162921 1.810515
H 3.172620 2.253020 0.769517
H 1.224919 -1.367720 -0.252883
H 1.501067 1.625789 -0.859115
H 0.760421 2.826543 0.264681
H 1.989975 -3.751171 -0.080868
H 3.702488 -3.219113 -0.101265
H 2.645398 -2.805839 1.286125
H 2.037373 -0.860336 -2.591219
H 1.600683 -2.583823 -2.375395
H 3.323486 -2.084486 -2.414261
H 1.885723 2.917694 2.623911
H -0.547386 2.384552 -1.649789
H -0.923334 -0.861291 1.930811
H -4.478007 0.614750 -2.167339
H -2.709697 2.240136 -2.872171
H -5.251864 -1.183423 -0.608301
H -2.687135 -2.495320 2.647967
H -4.848279 -2.656598 1.373271


