%chk=000135667.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135667

0 1
 O    1.077900       1.336600     -0.6799000    
 N    2.554700     -4.8000000E-02  0.4510000    
 N    5.973600       1.280000     -0.1967000    
 N   -1.422200      0.8462000     -6.0699999E-02
 C   -1.052500     -0.4489000     -3.6899999E-02
 C   -1.995200      -1.489100      2.4900001E-02
 C   0.2971000     -0.7897000     -7.3600002E-02
 C    3.660500      0.8819000      0.4892000    
 C    4.880900      0.3163000     -0.2220000    
 C  -0.2200000      -3.144600      1.0700000E-02
 C   -1.575300      -2.830500      4.8400000E-02
 C   -3.738500      0.2027000      3.7099998E-02
 C   -3.349000      -1.140300      6.1500002E-02
 C   0.7178000      -2.121700     -5.0600000E-02
 C   -2.727600       1.176600     -2.5200000E-02
 C    1.322300      0.2463000     -0.1387000    
 C   -5.091700      0.5819000      7.3100001E-02
 C   0.2222000      -4.567700      3.5399999E-02
 C   -3.109100       2.515500     -4.9899999E-02
 C    7.139500      0.7575000     -0.9124000    
 C    6.334200       1.616000       1.182100    
 C   -5.446600       1.927300      4.7400001E-02
 C   -4.453000       2.895800     -1.4200000E-02
 H    3.360400       1.839300      4.9300000E-02
 H    3.842000       1.041500       1.556100    
 H    5.173500     -0.6376000      0.2376000    
 H    4.607100      9.3699999E-02  -1.261600    
 H   -2.313400      -3.629200      9.4499998E-02
 H   -4.106900      -1.921300      0.1097000    
 H    1.768100      -2.393100     -0.1179000    
 H    2.679100     -0.9137000      0.9653000    
 H   -5.876500     -0.1698000      0.1213000    
 H    1.157600      -4.678600      0.5945000    
 H  -0.5203000      -5.207200      0.5246000    
 H   0.3764000      -4.931200     -0.9853000    
 H   -2.348900       3.293200     -9.7999997E-02
 H    6.882300      0.5311000      -1.953200    
 H    7.535500     -0.1532000     -0.4484000    
 H    7.939500       1.505500     -0.9444000    
 H    6.514200      0.7267000       1.797100    
 H    5.575500       2.241500       1.662200    
 H    7.248900       2.221500       1.199500    
 H   -6.492400       2.217200      7.5300001E-02
 H   -4.719000       3.948600     -3.4699999E-02


%chk=000135667-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135667

0 1
O 2.939616 -1.799980 -1.289339
N 2.013263 0.257499 -0.694897
N 5.464957 1.634895 0.141932
N -0.588906 0.304253 0.006172
C -0.615962 -1.047294 -0.231399
C -1.841330 -1.826852 -0.050062
C 0.583523 -1.741830 -0.672846
C 3.265397 0.998463 -0.888444
C 4.240254 0.821014 0.305875
C -0.681693 -3.892844 -0.731015
C -1.837588 -3.240727 -0.307234
C -2.985635 0.245170 0.625564
C -3.006314 -1.147952 0.379439
C 0.516495 -3.115981 -0.905025
C -1.724920 0.948348 0.421232
C 1.941971 -1.096262 -0.908733
C -4.138486 0.987061 1.062370
C -0.652865 -5.381969 -1.010284
C -1.672102 2.364468 0.663167
C 6.638725 1.064069 0.831323
C 5.267803 3.058257 0.475737
C -4.052862 2.357698 1.287210
C -2.808058 3.050441 1.085246
H 3.773798 0.633154 -1.797578
H 3.014409 2.064647 -1.033465
H 3.701011 1.054323 1.259863
H 4.523395 -0.245706 0.339316
H -2.769059 -3.802679 -0.163098
H -3.936808 -1.711904 0.522231
H 1.444717 -3.598495 -1.235916
H 1.127185 0.707298 -0.375659
H -5.084724 0.454184 1.214713
H 0.099790 -5.889134 -0.377876
H -1.632094 -5.853382 -0.821160
H -0.373546 -5.582361 -2.061838
H -0.717998 2.876963 0.504708
H 6.804069 0.028523 0.486617
H 6.539628 1.047539 1.947318
H 7.539211 1.655004 0.581550
H 5.034388 3.226711 1.559531
H 4.440478 3.483275 -0.119004
H 6.182226 3.628290 0.230754
H -4.932581 2.919099 1.619459
H -2.760078 4.129705 1.267041


