%chk=000073999.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073999

0 1
 O    5.242200     -0.3529000      0.2513000    
 N   -1.963200     -4.3600000E-02  0.2251000    
 N  -0.7292000      0.5030000     -0.2762000    
 N   0.4008000     -0.2467000      0.1806000    
 C   -2.151200      -1.399700     -0.2972000    
 C   -3.047100      0.8298000     -0.2229000    
 C    1.608100      0.4154000     -0.2966000    
 C    2.847800     -0.3175000      0.2061000    
 C   -3.465400      -1.994500      0.1797000    
 C   -2.869800       2.241900      0.3089000    
 C    4.127200      0.3648000     -0.2589000    
 H   -2.118300      -1.428000      -1.394700    
 H   -1.357000      -2.063200      6.6799998E-02
 H   -3.131400      0.8580000      -1.317500    
 H   -4.009600      0.4863000      0.1705000    
 H    1.623600      0.4310000      -1.393900    
 H    1.637900       1.455600      5.3199999E-02
 H    2.843000     -0.3671000       1.302900    
 H    2.845600      -1.359100     -0.1404000    
 H  -0.7438000      0.5023000      -1.296900    
 H   0.3965000     -0.2580000       1.200000    
 H   -3.599200      -1.869900       1.259800    
 H   -4.330600      -1.569100     -0.3380000    
 H   -3.476500      -3.070600     -2.7799999E-02
 H   -2.753000       2.246800       1.398300    
 H   -2.009300       2.753400     -0.1346000    
 H   -3.756000       2.840800      7.1099997E-02
 H    4.185100       1.398500      9.6699998E-02
 H    4.195400      0.3692000      -1.351100    
 H    5.191700     -0.3233000       1.222000    


%chk=000073999-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073999

0 1
O 4.917880 0.205591 1.030432
N -1.780494 -0.181956 -0.318329
N -0.811634 -0.071626 -1.425523
N 0.493698 -0.586704 -1.122225
C -2.490516 -1.499190 -0.354228
C -2.699754 0.993514 -0.350782
C 1.318446 0.396952 -0.377279
C 2.687322 -0.221424 -0.030822
C -3.273134 -1.807516 0.935810
C -1.962065 2.308423 -0.061290
C 3.591939 0.768476 0.725752
H -3.174704 -1.567546 -1.239602
H -1.713729 -2.278226 -0.487366
H -3.226007 1.060269 -1.335074
H -3.473824 0.823780 0.419963
H 1.452247 1.277779 -1.030665
H 0.805591 0.741907 0.550205
H 2.537502 -1.128123 0.596890
H 3.193595 -0.545922 -0.958289
H -1.159808 -0.551977 -2.277275
H 0.444911 -1.483176 -0.597804
H -2.615199 -1.693770 1.815262
H -4.142843 -1.140200 1.066286
H -3.651473 -2.845868 0.912109
H -1.504635 2.281557 0.943809
H -1.163492 2.462382 -0.805598
H -2.662440 3.162813 -0.107149
H 3.089206 1.116687 1.654801
H 3.810299 1.650833 0.100615
H 4.797413 -0.614139 1.573664


