%chk=000118006.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118006

0 1
 O    1.137800       1.716100     -0.5455000    
 N   -1.683900      -3.164200      0.9452000    
 C   -2.137400      0.1535000     -7.7699997E-02
 C   -2.817100      -1.147900     -0.3398000    
 C  -0.8016000      0.3284000     -0.4393000    
 C  -0.1657000       1.545300     -0.1928000    
 C   -2.837300       1.195300      0.5306000    
 C   -2.896500      -1.482800      -1.841600    
 C  -0.8658000       2.587200      0.4156000    
 C   -2.201600       2.412000      0.7774000    
 C    2.025700      0.6983000     -0.2401000    
 C   -2.181900      -2.275400      0.3895000    
 C    1.978700      0.1166000       1.013700    
 C    2.937800      0.2912000      -1.196900    
 C    2.874300     -0.9077000       1.321300    
 C    3.833100     -0.7332000     -0.8894000    
 C    3.801500      -1.332600      0.3697000    
 H   -3.854200      -1.086600      1.7800000E-02
 H  -0.2685000     -0.4808000     -0.9326000    
 H   -3.878300       1.076200      0.8190000    
 H   -3.479500      -2.396900      -2.003500    
 H   -1.905900      -1.646900      -2.280800    
 H   -3.380100     -0.6712000      -2.396900    
 H  -0.3758000       3.537200      0.6108000    
 H   -2.746400       3.223300       1.251300    
 H    1.282500      0.4451000       1.779800    
 H    2.963500      0.7569000      -2.177300    
 H    2.853300      -1.371000       2.303400    
 H    4.555300      -1.063900      -1.630200    
 H    4.499500      -2.129300      0.6096000    


%chk=000118006-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118006

0 1
O 1.192262 1.647709 -0.306149
N -1.707785 -3.213026 0.951976
C -2.249346 0.157413 -0.016734
C -2.994738 -1.173647 -0.202582
C -0.847891 0.226103 -0.199710
C -0.190704 1.471213 -0.077201
C -2.981366 1.332866 0.275530
C -3.241658 -1.485424 -1.712547
C -0.914953 2.651938 0.206103
C -2.311419 2.574169 0.378717
C 2.124138 0.592836 -0.101654
C -2.281292 -2.299277 0.441555
C 2.041884 -0.299822 0.992126
C 3.210495 0.549077 -1.001781
C 3.061289 -1.262254 1.165723
C 4.225732 -0.413707 -0.810184
C 4.153310 -1.325884 0.268913
H -3.980510 -1.092862 0.296705
H -0.276317 -0.679813 -0.427884
H -4.065965 1.280781 0.425918
H -3.809616 -2.423970 -1.833592
H -2.283459 -1.580438 -2.250465
H -3.814014 -0.658599 -2.166605
H -0.374749 3.599484 0.287621
H -2.878737 3.483201 0.605153
H 1.206676 -0.244357 1.697109
H 3.245139 1.264885 -1.828496
H 2.999240 -1.959612 2.008071
H 5.070576 -0.451878 -1.506543
H 4.939279 -2.074906 0.411208


