%chk=000165454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165454

0 1
 O   -4.620100      -1.168400     -0.4911000    
 O    4.724300       1.118700     -0.2392000    
 O    6.258200     -0.3787000      -1.044900    
 N   -4.759700      0.3195000       1.321900    
 C    1.332500      0.6782000      0.4851000    
 C    2.071100     -0.6503000      0.2271000    
 C  -2.8600000E-02  0.7697000     -0.2123000    
 C  -0.9263000     -0.4245000      0.2251000    
 C   -2.301100     -0.4235000     -0.5526000    
 C    3.375900     -0.3662000       1.020200    
 C   -2.799300       1.045300     -0.8296000    
 C    1.209900      -1.772400      0.8267000    
 C  -0.1963000      -1.796700      0.2046000    
 C    2.392100       1.734900      0.1791000    
 C  -0.7053000       2.118200      0.1072000    
 C    3.679900       1.106900      0.7365000    
 C   -3.374300      -1.262400      0.2242000    
 C   -2.230600       2.051400      0.1777000    
 C   -4.340400       1.152600     -0.9447000    
 C    2.328300     -0.9336000      -1.274700    
 C   -2.149700      -1.088000      -1.953500    
 C    4.647200      -1.076000      0.6196000    
 C   -5.086900      0.1248000     -9.1499999E-02
 C   -3.810800     -0.7663000       1.600600    
 C    5.309900     -0.1133000     -0.3216000    
 H    1.131300      0.7521000       1.567900    
 H   0.1179000      0.7271000      -1.297800    
 H   -1.139600     -0.2422000       1.286500    
 H    3.180100     -0.5110000       2.090800    
 H   -2.403700       1.372600      -1.803400    
 H  -0.1034000      -2.173700     -0.8173000    
 H  -0.7982000      -2.536600      0.7453000    
 H    1.108000      -1.636600       1.911200    
 H    1.694000      -2.745700      0.6818000    
 H    2.468300       1.947400     -0.8927000    
 H    2.168100       2.678300      0.6881000    
 H  -0.4093000       2.843000     -0.6622000    
 H  -0.3441000       2.528600       1.058400    
 H    4.032500       1.634500       1.629600    
 H   -3.086700      -2.318100      0.2698000    
 H   -2.527100       1.791800       1.198900    
 H   -2.632900       3.054300     -9.9999998E-03
 H   -4.683100       2.169300     -0.7186000    
 H   -4.602400      0.9620000      -1.994300    
 H    2.945000     -0.1675000      -1.751900    
 H    2.833100      -1.896100      -1.409900    
 H    1.405700     -0.9837000      -1.859000    
 H   -1.304700     -0.6666000      -2.507900    
 H   -1.999500      -2.170000      -1.878100    
 H   -3.044800     -0.9410000      -2.568900    
 H    4.469500      -2.043900      0.1478000    
 H    5.307400      -1.204600       1.483600    
 H   -6.165200      0.1895000     -0.2687000    
 H   -4.352100      -1.569900       2.115900    
 H   -2.999100     -0.4444000       2.254600    
 H   -5.592300      0.1784000       1.893200    


%chk=000165454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165454

0 1
O -4.678562 -1.236852 -0.477061
O 4.823161 1.154089 -0.234067
O 6.400826 -0.331423 -1.070235
N -4.943583 0.295116 1.306981
C 1.335022 0.670332 0.469314
C 2.084545 -0.678606 0.225112
C -0.047537 0.779714 -0.201899
C -0.938696 -0.433364 0.226498
C -2.315555 -0.437135 -0.552406
C 3.402706 -0.394762 1.024284
C -2.814673 1.045905 -0.809477
C 1.202297 -1.806464 0.812774
C -0.200332 -1.804882 0.148934
C 2.406589 1.752493 0.176127
C -0.731765 2.128840 0.189525
C 3.698429 1.126163 0.757939
C -3.388322 -1.236530 0.265102
C -2.280520 2.047114 0.242283
C -4.359830 1.133085 -1.009852
C 2.374137 -0.936720 -1.278810
C -2.187496 -1.123791 -1.941524
C 4.704227 -1.103315 0.604787
C -5.167113 0.147340 -0.147816
C -3.798957 -0.618566 1.642665
C 5.427693 -0.122411 -0.329492
H 1.140500 0.706626 1.568386
H 0.079945 0.754683 -1.304281
H -1.158028 -0.259902 1.304125
H 3.190857 -0.547726 2.098880
H -2.359690 1.358533 -1.773699
H -0.085701 -2.113920 -0.904764
H -0.824050 -2.584631 0.629085
H 1.099306 -1.651772 1.907824
H 1.675053 -2.799308 0.670198
H 2.533364 1.914562 -0.909725
H 2.174713 2.728691 0.633568
H -0.423125 2.907316 -0.535447
H -0.353023 2.458361 1.178568
H 4.071898 1.656390 1.651333
H -3.090560 -2.293815 0.360357
H -2.633083 1.772658 1.251417
H -2.708862 3.047772 0.038406
H -4.703242 2.163888 -0.799214
H -4.615401 0.910722 -2.063717
H 3.042653 -0.175844 -1.716974
H 2.851100 -1.923865 -1.422085
H 1.447869 -0.937640 -1.876693
H -1.339014 -0.703463 -2.514252
H -2.041346 -2.215649 -1.860079
H -3.111494 -0.968503 -2.522831
H 4.562781 -2.066412 0.088951
H 5.366362 -1.293418 1.470391
H -6.240796 0.178743 -0.396471
H -4.127621 -1.420686 2.329712
H -2.968909 -0.077499 2.126670
H -5.786546 0.036937 1.835277


