%chk=000120873.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120873

0 1
 O    1.268300       1.007200      -2.123000    
 N    3.339400       1.052400     -0.1239000    
 C    3.569100     -0.3810000      0.1057000    
 C    4.252300       1.872800      0.6844000    
 C    5.007500     -0.7715000     -0.2384000    
 C    5.712900       1.556000      0.3595000    
 C    6.011700      7.1800001E-02  0.5388000    
 C    1.948300       1.400200      0.1642000    
 C    1.001000      0.6392000     -0.7686000    
 C  -0.4334000       1.007400     -0.4824000    
 C   -1.454700      0.1809000     -0.1642000    
 C   -2.795900      0.7895000      3.3599999E-02
 C   -1.221800      -1.273200     -1.4000000E-02
 C   -3.151200       1.222600       1.294200    
 C   -1.361900      -2.093500      -1.117800    
 C   -3.642700      0.9018000      -1.049500    
 C  -0.8704000      -1.772700       1.226000    
 C   -4.410100       1.793600       1.480200    
 C   -1.142800      -3.463700     -0.9762000    
 C   -4.901700       1.472900     -0.8635000    
 C  -0.6513000      -3.143100       1.367300    
 C   -5.285300       1.918800      0.4015000    
 C  -0.7874000      -3.988500      0.2661000    
 H    2.952000      -1.011900     -0.5377000    
 H    3.350100     -0.6532000       1.146500    
 H    4.071900       1.717200       1.756300    
 H    4.081000       2.935900      0.4760000    
 H    5.177100     -0.6414000      -1.315000    
 H    5.167300      -1.832600     -1.5600000E-02
 H    6.372300       2.146400       1.005700    
 H    5.931300       1.850400     -0.6748000    
 H    5.959900     -0.1860000       1.603700    
 H    7.030300     -0.1504000      0.2024000    
 H    1.697500       1.195200       1.213600    
 H    1.816400       2.477600     -3.8000001E-03
 H    1.110900     -0.4417000     -0.6968000    
 H  -0.6480000       2.072800     -0.5817000    
 H    2.201300      0.7986000      -2.301400    
 H   -2.477700       1.131000       2.141600    
 H   -1.636600      -1.696600      -2.091200    
 H   -3.354500      0.5588000      -2.039200    
 H  -0.7593000      -1.124400       2.090800    
 H   -4.708900       2.141000       2.464900    
 H   -1.248200      -4.122000      -1.833700    
 H   -5.583200       1.570700      -1.703400    
 H  -0.3738000      -3.551800       2.334600    
 H   -6.265600       2.363500      0.5462000    
 H  -0.6163000      -5.055300      0.3763000    


%chk=000120873-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120873

0 1
O 1.488011 0.347363 -1.590656
N 3.472011 0.926983 0.104030
C 4.046198 -0.318676 0.687771
C 4.406287 2.078970 0.231664
C 5.381689 -0.685381 0.010377
C 5.749390 1.778645 -0.463599
C 6.385663 0.487014 0.100579
C 2.100280 1.217449 0.605424
C 1.078683 0.333418 -0.167176
C -0.328487 0.854425 -0.033684
C -1.472665 0.097338 0.033664
C -2.789935 0.775941 0.261009
C -1.471520 -1.390279 -0.141050
C -2.894385 1.903340 1.123672
C -0.681735 -2.011230 -1.150723
C -3.968290 0.324556 -0.396748
C -2.284534 -2.214633 0.687471
C -4.125630 2.568585 1.305456
C -0.700498 -3.414101 -1.312860
C -5.199706 0.990361 -0.217478
C -2.294355 -3.616536 0.528316
C -5.285354 2.117228 0.633116
C -1.502379 -4.223624 -0.475125
H 3.315597 -1.136433 0.554448
H 4.207196 -0.190317 1.788107
H 4.595389 2.319260 1.308763
H 3.926633 2.963234 -0.226890
H 5.188366 -0.928552 -1.052555
H 5.796293 -1.593329 0.488527
H 6.430590 2.640791 -0.330392
H 5.570186 1.659652 -1.550007
H 6.667536 0.649298 1.161790
H 7.315860 0.243543 -0.446267
H 1.997261 1.059782 1.703268
H 1.882624 2.280365 0.388166
H 1.127979 -0.710002 0.209258
H -0.428672 1.949079 -0.022258
H 2.484548 0.523503 -1.523255
H -2.007863 2.239792 1.673398
H -0.068520 -1.385913 -1.810607
H -3.910128 -0.542368 -1.063680
H -2.904154 -1.750428 1.463120
H -4.184066 3.430296 1.980315
H -0.093277 -3.873688 -2.101129
H -6.091675 0.632174 -0.743926
H -2.919969 -4.234295 1.182736
H -6.242718 2.630798 0.776309
H -1.516657 -5.311698 -0.606388


