%chk=000150309.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150309

0 1
 O    3.524000     -1.4000000E-03   1.126200    
 N   -4.247200      1.2000001E-03  0.5356000    
 C    2.356200      0.7557000       1.481500    
 C    2.355700     -0.7577000       1.481400    
 C    1.750900       1.615600      0.3998000    
 C    1.749600      -1.616900      0.3995000    
 C  -0.1217000      1.9999999E-04 -9.4999997E-03
 C   0.5483000       1.294600     -0.2667000    
 C   0.5474000      -1.294500     -0.2670000    
 C   -1.360700      6.9999998E-04  0.5011000    
 C   -2.124400      -1.261100      0.7972000    
 C   -2.124200       1.263400      0.7942000    
 C   -3.511100      -1.213300      0.1456000    
 C   -3.510700       1.214400      0.1423000    
 C    2.375800       2.832600      6.2600002E-02
 C    2.373500      -2.834200      6.1999999E-02
 C   1.2200000E-02   2.167300      -1.230900    
 C   1.0500000E-02  -2.166500      -1.231600    
 C    1.838600       3.696100     -0.8934000    
 C    1.835600      -3.697000     -0.8944000    
 C   0.6545000       3.363800      -1.538900    
 C   0.6519000      -3.363500      -1.539800    
 C   -5.584500      5.0000002E-04 -5.7000000E-02
 H    2.367500       1.212000       2.469000    
 H    2.366600      -1.214300       2.468700    
 H   -1.647500      -2.207100      0.5458000    
 H   -2.257700      -1.309300       1.888100    
 H   -2.257800       1.313800       1.884900    
 H   -1.647300       2.208900      0.5414000    
 H   -3.411100      -1.276300     -0.9464000    
 H   -4.070100      -2.098800      0.4726000    
 H   -4.069400       2.100900      0.4669000    
 H   -3.410500       1.274400     -0.9499000    
 H    3.299700       3.117700      0.5628000    
 H    3.297100      -3.120200      0.5621000    
 H  -0.8940000       1.910300      -1.775500    
 H  -0.8957000      -1.908600      -1.776000    
 H    2.345700       4.626900      -1.130100    
 H    2.341900      -4.628000      -1.131200    
 H   0.2364000       4.029000      -2.288300    
 H   0.2332000      -4.028200      -2.289400    
 H   -6.150700      0.8795000      0.2704000    
 H   -6.150900     -0.8776000      0.2728000    
 H   -5.552400     -1.1000000E-03  -1.152500    


%chk=000150309-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150309

0 1
O 3.634249 -0.000772 1.238755
N -4.375426 0.000854 0.524412
C 2.331431 0.748449 1.506289
C 2.330992 -0.749161 1.506432
C 1.787505 1.587679 0.389948
C 1.786585 -1.588295 0.390246
C -0.185391 0.000204 0.064618
C 0.563828 1.263710 -0.263561
C 0.563094 -1.263757 -0.263324
C -1.458097 0.000395 0.577101
C -2.252863 -1.255737 0.901388
C -2.252508 1.256518 0.902457
C -3.623612 -1.226494 0.177534
C -3.623276 1.228305 0.178611
C 2.491251 2.763684 0.030631
C 2.489552 -2.764866 0.031268
C 0.089918 2.130583 -1.284725
C 0.088292 -2.130877 -1.283847
C 2.007704 3.617141 -0.982365
C 2.005284 -3.618433 -0.981293
C 0.798659 3.296909 -1.642958
C 0.796250 -3.297791 -1.641718
C -5.742127 0.001281 -0.030846
H 2.349394 1.240237 2.490368
H 2.348645 -1.240753 2.490616
H -1.708138 -2.175967 0.635072
H -2.453826 -1.280946 1.991317
H -2.453513 1.280822 1.992401
H -1.707577 2.176853 0.637015
H -3.453072 -1.306682 -0.929896
H -4.226817 -2.101968 0.483402
H -4.226225 2.103675 0.485280
H -3.452738 1.309429 -0.928753
H 3.431634 2.997028 0.543353
H 3.429831 -2.998633 0.543990
H -0.835999 1.867860 -1.808969
H -0.837694 -1.867907 -1.807851
H 2.567474 4.517369 -1.258278
H 2.564403 -4.519164 -1.256886
H 0.415502 3.946711 -2.437695
H 0.412467 -3.947769 -2.436008
H -6.287201 0.895238 0.321957
H -6.287437 -0.892843 0.321167
H -5.767205 0.001779 -1.150655


