%chk=000128300.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128300

0 1
 O  -0.6661000      0.7460000       2.112800    
 O   -3.003600       3.836700     -0.3582000    
 N   -1.820500       2.258300      0.8309000    
 N   -4.693200      -2.591900      0.1014000    
 C   -1.264400      3.4800000E-02 -0.1347000    
 C   1.9400001E-02 -0.8258000     -8.0399998E-02
 C   -1.247800      0.8545000      -1.444700    
 C    1.277500      4.1200001E-02 -0.1215000    
 C   -2.484300     -0.8999000     -5.0600000E-02
 C   -1.194600       1.029200       1.035900    
 C   -2.418500       1.823500      -1.508100    
 C    2.543900     -0.8121000     -3.3399999E-02
 C    3.802500      5.7100002E-02 -4.0500000E-02
 C   -2.437000       2.744800     -0.3158000    
 C    5.070200     -0.7987000      1.3900000E-02
 C   -2.689800      -1.855100      -1.033700    
 C   -3.371700     -0.7815000       1.007700    
 C    6.328200      7.1599998E-02 -2.6500000E-02
 C    7.626900     -0.7374000     -6.0999999E-03
 C   -3.802600      -2.671800     -0.9126000    
 C   -4.454000      -1.646100       1.037500    
 C    8.879400      0.1225000     -7.3299997E-02
 H   5.6800000E-02  -1.531000     -0.9204000    
 H   2.9700000E-02  -1.437000      0.8327000    
 H  -0.3512000       1.477400      -1.524400    
 H   -1.260400      0.2080000      -2.329800    
 H    1.305200      0.7781000      0.6857000    
 H    1.348200      0.5905000      -1.064300    
 H   -2.333500       2.436300      -2.412700    
 H   -3.377400       1.296900      -1.552200    
 H    2.520900      -1.411400      0.8850000    
 H    2.574200      -1.513000     -0.8765000    
 H    3.783700      0.7413000      0.8164000    
 H    3.816500      0.6743000     -0.9471000    
 H   -1.816900       2.889100       1.628000    
 H    5.081300      -1.494900     -0.8335000    
 H    5.070600      -1.402500      0.9293000    
 H   -2.022500      -1.979000      -1.878600    
 H   -3.269700     -5.8899999E-02   1.807200    
 H    6.309400      0.6915000     -0.9317000    
 H    6.320700      0.7597000      0.8279000    
 H    7.661700      -1.344200      0.9065000    
 H    7.632900      -1.435400     -0.8519000    
 H   -4.013800      -3.436200      -1.653000    
 H   -5.180800      -1.599300       1.841900    
 H    8.927000      0.8092000      0.7777000    
 H    9.774600     -0.5068000     -5.4600000E-02
 H    8.897400      0.7145000     -0.9938000    


%chk=000128300-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128300

0 1
O -0.876468 0.941734 2.102570
O -3.403562 3.893974 -0.392347
N -2.114990 2.357085 0.767778
N -4.498988 -2.874243 0.188752
C -1.317689 0.179670 -0.219007
C 0.017611 -0.638335 -0.122789
C -1.391461 1.001684 -1.536075
C 1.323407 0.170385 -0.291229
C -2.477929 -0.843345 -0.080611
C -1.394195 1.161920 0.974128
C -2.650261 1.888918 -1.610313
C 2.571152 -0.688849 0.018160
C 3.898334 0.073839 -0.191184
C -2.773711 2.805837 -0.403260
C 5.147879 -0.773372 0.138791
C -3.111255 -1.417779 -1.212375
C -2.883130 -1.325694 1.191143
C 6.476163 -0.013995 -0.077780
C 7.726413 -0.858804 0.257857
C -4.098435 -2.413125 -1.032379
C -3.881179 -2.321128 1.275373
C 9.048874 -0.092880 0.037622
H -0.027274 -1.441101 -0.885707
H 0.031454 -1.133582 0.865937
H -0.495711 1.645357 -1.599065
H -1.346013 0.327135 -2.409214
H 1.313827 1.044474 0.390315
H 1.410167 0.562953 -1.324283
H -2.651143 2.527947 -2.509509
H -3.568664 1.271849 -1.656565
H 2.513845 -1.046588 1.066584
H 2.564469 -1.595677 -0.622760
H 3.898769 0.987265 0.439633
H 3.960213 0.422563 -1.243612
H -2.183927 2.978548 1.584452
H 5.144746 -1.691041 -0.486379
H 5.089666 -1.116057 1.193073
H -2.850406 -1.116508 -2.231576
H -2.426316 -0.940298 2.108221
H 6.537856 0.325837 -1.133094
H 6.479526 0.905461 0.544608
H 7.664625 -1.196958 1.312492
H 7.722319 -1.777972 -0.363309
H -4.595269 -2.864936 -1.898759
H -4.206231 -2.699941 2.250871
H 9.092756 0.812712 0.671889
H 9.926394 -0.719322 0.282349
H 9.148241 0.231482 -1.015616


