%chk=000226625.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226625

0 1
 O   -2.031000       2.331500     -0.5591000    
 N  -0.6024000      0.5521000     -0.1223000    
 N   0.5810000      0.1074000      0.4876000    
 N  -0.1517000       2.709500      0.6755000    
 C   -1.868800      -1.582300      6.5399997E-02
 C   -1.396800     -0.4327000     -0.8413000    
 C    3.031300     -0.2652000      0.2278000    
 C    1.718000      0.2031000     -0.4219000    
 C   -2.684600      -1.018600       1.231900    
 C   -2.701200      -2.622000     -0.6895000    
 C    2.882000      -1.710400      0.7111000    
 C    4.226700     -0.1618000     -0.7230000    
 C   -1.002400       1.889400     -4.2300001E-02
 H  -0.9954000      -2.100100      0.4817000    
 H  -0.7842000     -0.8289000      -1.659900    
 H   -2.262400      5.2900001E-02  -1.306400    
 H    3.240300      0.3687000       1.099400    
 H    1.847900       1.238500     -0.7608000    
 H    1.531400     -0.4030000      -1.317500    
 H   0.7356000      0.6153000       1.354100    
 H   -3.543500     -0.4402000      0.8741000    
 H   -3.066900      -1.829400       1.861900    
 H   -2.081600     -0.3711000       1.876100    
 H   -3.608600      -2.174500      -1.108600    
 H   -2.999600      -3.440800     -2.6400000E-02
 H   -2.122900      -3.051000      -1.514500    
 H    2.613200      -2.380600     -0.1128000    
 H    3.822200      -2.071100       1.142700    
 H    2.117100      -1.801600       1.489100    
 H    4.085300     -0.7921000      -1.607500    
 H    5.150400     -0.4748000     -0.2251000    
 H    4.360600      0.8710000      -1.061200    
 H  -0.3711000       3.692900      0.7971000    
 H   0.7408000       2.406700       1.045400    


%chk=000226625-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226625

0 1
O -2.108056 2.436821 -0.341317
N -0.595917 0.668775 -0.025216
N 0.663370 0.279246 0.526442
N -0.158253 2.779151 0.913253
C -1.916240 -1.499556 -0.040943
C -1.395722 -0.271452 -0.835033
C 3.101646 -0.210137 0.182436
C 1.713222 -0.048622 -0.481507
C -2.850696 -1.070112 1.112091
C -2.622438 -2.477036 -1.009088
C 3.119370 -1.358071 1.222026
C 4.174083 -0.442401 -0.907316
C -1.021012 2.004716 0.155350
H -1.041221 -2.033238 0.395160
H -0.799627 -0.619603 -1.704508
H -2.247215 0.315731 -1.222132
H 3.328867 0.739877 0.708082
H 1.737234 0.789783 -1.201334
H 1.479406 -0.975670 -1.057066
H 0.528711 -0.483307 1.208025
H -3.760720 -0.585059 0.712398
H -3.161979 -1.941070 1.718282
H -2.355673 -0.341234 1.779467
H -3.501673 -1.994766 -1.477426
H -2.977737 -3.376340 -0.473595
H -1.945761 -2.808577 -1.819619
H 2.819475 -2.316530 0.754402
H 4.135551 -1.492180 1.635878
H 2.444908 -1.160413 2.076157
H 3.983036 -1.385441 -1.455057
H 5.181616 -0.512891 -0.458458
H 4.186510 0.382180 -1.644045
H -0.416063 3.745119 1.087606
H 0.687696 2.349108 1.287405


