%chk=000034390.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034390

0 1
 O   0.1337000      0.2330000     -0.2303000    
 O   -4.527900      -1.340100     -0.6231000    
 O   0.2643000      0.9274000       1.990900    
 O    1.998400       3.649200      -1.356300    
 O   0.1368000       2.559700     -0.9481000    
 N    1.574500      -1.999200      0.4025000    
 N    1.387900       2.609800      -1.011900    
 C    2.221500     -0.8781000      3.1500001E-02
 C    3.629100     -0.8205000     -4.1099999E-02
 C    1.501500      0.2681000     -0.2939000    
 C    2.139900       1.448300     -0.6827000    
 C    4.271500      0.3665000     -0.4321000    
 C    3.526600       1.498000     -0.7520000    
 C    4.354400      -1.974000      0.2863000    
 C   -1.869600      0.5313000       1.003400    
 C  -0.3857000      0.5931000       1.011600    
 C   -2.494700     -0.3860000      0.1841000    
 C   -3.888400     -0.4443000      0.1775000    
 C    3.690500      -3.130800      0.6688000    
 C   -2.576600       1.393100       1.816400    
 C    2.311600      -3.090900      0.7103000    
 C   -4.626200      0.4163000      0.9903000    
 C   -3.970200       1.335100       1.809600    
 C   -3.877400      -1.703900      -1.839700    
 C   -4.925700      -2.061100      -2.871700    
 H    5.356700      0.4155000     -0.4894000    
 H    4.064000       2.394500      -1.049400    
 H    5.441200      -1.977400      0.2450000    
 H   -1.905100      -1.078500     -0.4082000    
 H    4.235500      -4.031500      0.9253000    
 H   -2.077300       2.114900       2.455900    
 H    1.738600      -3.964800       1.002300    
 H   -5.712100      0.3762000      0.9889000    
 H   -4.544800       2.005900       2.441600    
 H   -3.282600     -0.8772000      -2.248200    
 H   -3.228900      -2.567800      -1.657000    
 H   -4.460600      -2.356300      -3.816500    
 H   -5.553000      -2.884600      -2.514800    
 H   -5.591300      -1.211200      -3.055700    


%chk=000034390-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034390

0 1
O 0.156515 0.245524 -0.146189
O -4.728655 -0.804056 -1.023027
O 0.292805 0.975556 2.079432
O 1.871580 2.765656 -2.891837
O 0.353143 2.762749 -1.188914
N 1.686027 -1.699220 1.099787
N 1.405486 2.307466 -1.773623
C 2.337093 -0.767408 0.308522
C 3.762504 -0.796159 0.065734
C 1.542031 0.270755 -0.298787
C 2.168221 1.210221 -1.133027
C 4.355667 0.178207 -0.801383
C 3.570713 1.154714 -1.402864
C 4.516569 -1.829000 0.712497
C -1.872843 0.313683 1.148123
C -0.409580 0.550427 1.147512
C -2.551841 -0.147648 -0.009709
C -3.948744 -0.354933 0.048901
C 3.858090 -2.752560 1.525362
C -2.576439 0.568052 2.351596
C 2.436703 -2.651156 1.682406
C -4.658887 -0.105076 1.252925
C -3.971148 0.353584 2.393343
C -4.049336 -1.059262 -2.312400
C -5.121758 -1.531637 -3.289358
H 5.434715 0.147108 -0.987004
H 3.992961 1.899908 -2.081637
H 5.600231 -1.880968 0.559361
H -1.977180 -0.327542 -0.919591
H 4.402629 -3.552180 2.036382
H -2.024686 0.926284 3.225721
H 1.899080 -3.374727 2.305932
H -5.740050 -0.274542 1.265380
H -4.526843 0.545853 3.316949
H -3.565727 -0.124545 -2.662203
H -3.266142 -1.831489 -2.167682
H -4.669312 -1.739448 -4.275956
H -5.603438 -2.454287 -2.923353
H -5.900054 -0.760203 -3.417219


