%chk=000059409.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059409

0 1
 O   0.1195000       1.130400      0.8231000    
 N   -3.972500     -0.4099000     -3.6899999E-02
 N   0.9942000       2.178800      -1.021200    
 N  -0.3541000       2.190000      -1.142300    
 C   -2.580800     -9.3800001E-02 -0.3567000    
 C   -2.200300       1.261900      0.2212000    
 C    1.337000       1.641900      0.2908000    
 C   -4.359100      -1.684400     -0.6408000    
 C   -4.167300     -0.4507000       1.412000    
 C  -0.7825000       1.557100     -9.7599998E-02
 C    2.401400      0.5750000      0.2182000    
 C   -4.166400      -1.667700      -2.143100    
 C   -5.615000     -0.7163000       1.769900    
 C    3.747500      0.9165000      0.3652000    
 C    2.044000     -0.7582000      4.1000000E-03
 C    4.371600      -1.400700      8.4700003E-02
 C    4.731400     -7.0000000E-02  0.2986000    
 C    3.027900      -1.744800     -6.2399998E-02
 C    5.423500      -2.455200      1.3200000E-02
 H   -2.424500     -1.9800000E-02  -1.438400    
 H   -1.898300     -0.8714000      1.2700000E-02
 H   -2.829200       2.058600     -0.1928000    
 H   -2.269200       1.316300       1.311000    
 H    1.660300       2.446900      0.9630000    
 H   -5.425300      -1.876000     -0.4813000    
 H   -3.804400      -2.526900     -0.2085000    
 H   -3.954000      0.5176000       1.871000    
 H   -3.521100      -1.195700       1.893100    
 H    1.379900       3.108400      -1.173600    
 H   -4.584400     -0.7634000      -2.598800    
 H   -3.115400      -1.761200      -2.433300    
 H   -4.686000      -2.524000      -2.588400    
 H   -6.298100     -6.5499999E-02   1.213100    
 H   -5.903500      -1.758700       1.603400    
 H   -5.773800     -0.5175000       2.836100    
 H    4.040900       1.949800      0.5313000    
 H    1.005300      -1.050900     -0.1223000    
 H    5.774800      0.2104000      0.4162000    
 H    2.735100      -2.778000     -0.2296000    
 H    5.613800      -2.864100       1.010500    
 H    5.119200      -3.272700     -0.6491000    
 H    6.360600      -2.052200     -0.3857000    


%chk=000059409-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059409

0 1
O 0.134446 1.125955 0.417958
N -3.945056 -0.640702 0.162524
N 1.054331 1.990474 -1.522936
N -0.381263 2.075707 -1.627053
C -2.558440 -0.333794 -0.265622
C -2.277653 1.196964 -0.212471
C 1.444734 1.660185 -0.115920
C -4.544085 -1.791645 -0.564754
C -4.070563 -0.750671 1.641325
C -0.856552 1.528487 -0.530859
C 2.542506 0.627746 -0.003539
C -4.960953 -1.436084 -2.004774
C -5.490485 -0.439766 2.152219
C 3.466849 0.694033 1.064607
C 2.658704 -0.418170 -0.951149
C 4.603514 -1.334330 0.255929
C 4.485080 -0.276112 1.192411
C 3.675920 -1.384081 -0.819959
C 5.679839 -2.395907 0.402685
H -2.417061 -0.673633 -1.306775
H -1.800064 -0.867412 0.354964
H -2.934033 1.707213 -0.935590
H -2.524582 1.575344 0.797094
H 1.686038 2.556477 0.503776
H -5.444674 -2.108134 -0.007648
H -3.853773 -2.673406 -0.575803
H -3.367655 -0.026063 2.093473
H -3.749676 -1.761188 2.002504
H 1.527080 2.778051 -1.974261
H -5.697343 -0.613817 -1.993314
H -4.098939 -1.110389 -2.614977
H -5.413181 -2.312891 -2.505317
H -5.789829 0.577552 1.845298
H -6.238290 -1.148152 1.751864
H -5.526839 -0.504346 3.255942
H 3.390009 1.504679 1.800658
H 1.959056 -0.442981 -1.793242
H 5.196750 -0.210913 2.024200
H 3.760056 -2.187269 -1.562566
H 5.266819 -3.318630 0.854757
H 6.107483 -2.677077 -0.576440
H 6.504478 -2.051403 1.050378


