%chk=000029233.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029233

0 1
 O    1.975200       1.294600      8.0300003E-02
 O    3.816200     -0.6398000      0.4018000    
 O    1.661000       1.218200       2.398800    
 O    4.142900     -0.8156000      -1.909600    
 N   -3.994900      -1.456500      0.1265000    
 C   -2.574000      -1.077000      0.3407000    
 C   -2.235800      0.3104000     -0.2153000    
 C   -1.610900      -2.111600     -0.2847000    
 C   -3.262500       1.244800     -0.4545000    
 C   -4.877400     -0.3779000      0.5992000    
 C   -4.704900      0.8624000     -0.2726000    
 C  -0.8786000      0.6648000     -0.4250000    
 C  -0.1665000      -1.702000     -0.1024000    
 C   0.1833000     -0.3361000     -0.1728000    
 C   -4.348000      -2.700500      0.8185000    
 C   -2.946600       2.520900     -0.9304000    
 C  -0.6000000       1.958500     -0.9018000    
 C    1.536700      2.0999999E-03  5.5999998E-03
 C   0.8164000      -2.684500      9.3400002E-02
 C   -1.621400       2.876100      -1.149600    
 C    2.508700     -0.9800000      0.2175000    
 C    2.149900      -2.322300      0.2555000    
 C    1.994400       1.813500       1.382800    
 C    4.565300     -0.5866000     -0.7840000    
 C    2.488000       3.229800       1.358600    
 C    5.983200     -0.2058000     -0.4765000    
 H   -2.380100      -1.022500       1.423300    
 H   -1.803600      -2.226100      -1.359700    
 H   -1.752100      -3.091300      0.1844000    
 H   -4.671600     -0.1383000       1.651500    
 H   -5.929500     -0.6838000      0.5383000    
 H   -5.256600       1.693100      0.1836000    
 H   -5.138300      0.6787000      -1.264100    
 H   -3.826500      -3.560300      0.3882000    
 H   -5.415900      -2.918400      0.6989000    
 H   -4.127900      -2.654100       1.891000    
 H   -3.733400       3.240900      -1.139800    
 H   0.3996000       2.285300      -1.164500    
 H   0.5445000      -3.736500      0.1265000    
 H   -1.381200       3.863500      -1.533600    
 H    2.900600      -3.090900      0.4172000    
 H    3.496300       3.261700      0.9384000    
 H    2.523600       3.618900       2.380100    
 H    1.805600       3.848900      0.7713000    
 H    6.005800      0.7782000     -1.6000000E-03
 H    6.556000     -0.1579000      -1.407000    
 H    6.434500     -0.9586000      0.1742000    


%chk=000029233-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029233

0 1
O 2.051549 1.137904 0.083321
O 3.860709 -0.956126 0.329412
O 1.334446 1.213019 2.321719
O 4.244601 -0.027314 -1.796637
N -3.983988 -1.396341 0.340697
C -2.528693 -1.092828 0.345494
C -2.213172 0.294856 -0.223062
C -1.717129 -2.121000 -0.483170
C -3.225696 1.252044 -0.474615
C -4.781844 -0.242613 0.828865
C -4.676626 0.922034 -0.165447
C -0.847153 0.596381 -0.522598
C -0.233575 -1.825980 -0.345193
C 0.181171 -0.457951 -0.302189
C -4.305665 -2.627046 1.095171
C -2.876624 2.508851 -1.027589
C -0.525313 1.853237 -1.099796
C 1.555348 -0.193882 -0.067722
C 0.715046 -2.863950 -0.228753
C -1.536084 2.804697 -1.347696
C 2.495493 -1.241181 0.029105
C 2.087775 -2.581600 -0.064915
C 1.857687 1.777284 1.347974
C 4.653812 -0.292715 -0.655327
C 2.362070 3.197728 1.264493
C 6.019446 -0.011393 -0.073652
H -2.133392 -1.125470 1.399174
H -2.049450 -2.046276 -1.538158
H -1.917237 -3.151857 -0.145411
H -4.445133 0.091642 1.844083
H -5.834425 -0.566942 0.920863
H -5.193440 1.814363 0.237489
H -5.197942 0.635691 -1.099827
H -3.820695 -3.506159 0.639406
H -5.396035 -2.796704 1.061769
H -3.993230 -2.576753 2.169068
H -3.664919 3.247920 -1.217206
H 0.508211 2.068046 -1.383297
H 0.377972 -3.905679 -0.265356
H -1.277650 3.768862 -1.799365
H 2.834862 -3.375942 0.019239
H 3.313618 3.244981 0.710978
H 2.480171 3.611626 2.276406
H 1.624453 3.808466 0.711826
H 5.925660 0.655449 0.801099
H 6.658942 0.457760 -0.834695
H 6.481566 -0.948739 0.280624


