%chk=000100214.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100214

0 1
 O   -5.721700      -2.959100      0.5119000    
 O    5.721700      -2.959200     -0.5116000    
 O   -2.656600       1.349800     -0.2810000    
 O    2.656800       1.349800      0.2792000    
 N   -2.792300      -1.256400     -0.2964000    
 N    2.792300      -1.256400      0.2965000    
 C   -4.990600      -2.278500     -0.4949000    
 C    4.990600      -2.278500      0.4951000    
 C   -5.697500      -1.527000      0.5688000    
 C    5.697500      -1.527100     -0.5688000    
 C   -3.492600      -2.499100     -0.3709000    
 C    3.492500      -2.499100      0.3711000    
 C  -0.6943000      3.7000000E-02 -7.3600002E-02
 C   0.6943000      3.7099998E-02  7.3399998E-02
 C   -1.388700      -1.176500     -0.1473000    
 C    1.388600      -1.176500      0.1473000    
 C  -0.6929000      -2.383500     -7.3500000E-02
 C   0.6928000      -2.383500      7.3600002E-02
 C   -1.439500       1.310100     -0.1520000    
 C    1.439500       1.310100      0.1519000    
 C  -0.6944000       2.583100     -7.3399998E-02
 C   0.6944000       2.583100      7.3200002E-02
 C   -1.388800       3.796500     -0.1466000    
 C    1.388800       3.796600      0.1468000    
 C  -0.6929000       5.003500     -7.2800003E-02
 C   0.6928000       5.003600      7.3700003E-02
 H   -5.367500      -2.252800      -1.506300    
 H    5.367500      -2.252600       1.506500    
 H   -5.131800      -1.071700       1.371300    
 H   -6.607900      -1.003000      0.3072000    
 H    5.131800      -1.072000      -1.371200    
 H    6.607800      -1.003000     -0.3072000    
 H   -3.174600      -3.076400      -1.247100    
 H   -3.300600      -3.103400      0.5248000    
 H    3.174500      -3.076400       1.247400    
 H    3.300400      -3.103400     -0.5246000    
 H   -3.309500     -0.3914000     -0.3919000    
 H    3.309400     -0.3913000      0.3923000    
 H   -1.175600      -3.354100     -0.1275000    
 H    1.175600      -3.354200      0.1277000    
 H   -2.469000       3.826200     -0.2606000    
 H    2.469100       3.826300      0.2609000    
 H   -1.232200       5.944700     -0.1295000    
 H    1.232100       5.944800      0.1309000    


%chk=000100214-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100214

0 1
O -6.075937 -3.110574 -0.146852
O 6.075858 -3.111035 0.146827
O -2.764569 1.358622 -0.216361
O 2.764584 1.359029 0.216217
N -2.810675 -1.204099 -0.229124
N 2.810796 -1.204262 0.229155
C -5.079782 -2.048501 -0.528478
C 5.079763 -2.048984 0.528674
C -6.012667 -1.805515 0.617951
C 6.012762 -1.805753 -0.617610
C -3.625904 -2.420557 -0.289116
C 3.625870 -2.420828 0.289072
C -0.720974 0.062998 -0.058934
C 0.721126 0.063032 0.058840
C -1.440366 -1.187737 -0.116977
C 1.440501 -1.187743 0.116927
C -0.691067 -2.416036 -0.054727
C 0.691175 -2.416032 0.054670
C -1.464841 1.324382 -0.116279
C 1.464862 1.324531 0.116092
C -0.710552 2.598234 -0.056072
C 0.710409 2.598300 0.056148
C -1.411047 3.831635 -0.111382
C 1.410770 3.831770 0.111647
C -0.708601 5.048914 -0.055822
C 0.708191 5.048982 0.056290
H -5.297107 -1.561680 -1.488948
H 5.297062 -1.562458 1.489299
H -5.632374 -1.894764 1.643181
H -6.878757 -1.148197 0.480193
H 5.632549 -1.894682 -1.642897
H 6.878897 -1.148548 -0.479597
H -3.285917 -3.086831 -1.109226
H -3.559530 -3.003317 0.653651
H 3.285692 -3.087181 1.109038
H 3.559565 -3.003447 -0.653788
H -3.232627 -0.244080 -0.250321
H 3.232847 -0.244287 0.250585
H -1.222109 -3.371593 -0.092794
H 1.222209 -3.371592 0.092787
H -2.501243 3.799326 -0.197533
H 2.500971 3.799567 0.197776
H -1.252965 5.998535 -0.098988
H 1.252452 5.998655 0.099607


