%chk=000178719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178719

0 1
 O    1.151300       2.808200      0.6306000    
 C   -1.988200     -0.3259000     -0.8182000    
 C  -0.5033000      2.3000000E-02 -0.7741000    
 C   -2.278400      -1.724600     -0.1972000    
 C   -2.945800      0.7570000     -0.2398000    
 C  -8.8000000E-02   1.462800     -0.9633000    
 C   0.4390000     -0.9495000     -0.7189000    
 C    1.923600     -0.6066000     -0.6466000    
 C   -2.340800      -1.713200       1.343300    
 C   -1.231800      -2.725400     -0.6128000    
 C   -2.449100       2.158100     -0.4624000    
 C    2.163100      0.7428000      1.9500000E-02
 C   -1.187400       2.464200     -0.7827000    
 C    1.075300       1.770100     -2.3399999E-02
 C   3.0900000E-02  -2.341200     -0.8458000    
 C   -3.324000      0.5692000       1.205200    
 C   -3.044800     -0.5291000       1.913400    
 C    2.796100      -1.710200      2.4499999E-02
 C    3.301300       1.034000      0.6710000    
 C    4.138600      -1.227200      0.5007000    
 C    4.362400      6.3699998E-02  0.7769000    
 H   -2.221800     -0.3925000      -1.894000    
 H   -3.250100      -2.059500     -0.5859000    
 H   -3.886100      0.6709000     -0.8044000    
 H   0.2816000       1.587500      -1.990700    
 H    2.272800     -0.5104000      -1.686400    
 H   -1.336500      -1.745800       1.785700    
 H   -2.855000      -2.622800       1.680500    
 H   -1.509800      -3.771100     -0.6984000    
 H   -3.168200       2.967400     -0.3581000    
 H  -0.9398000       3.511800     -0.9402000    
 H   0.7632000      -3.080400      -1.149600    
 H   -3.876800       1.367800       1.695300    
 H   -3.346200     -0.5771000       2.955900    
 H    2.967000      -2.515000     -0.7015000    
 H    2.276800      -2.156100      0.8827000    
 H    3.474400       1.994600       1.144600    
 H    4.933000      -1.955200      0.6322000    
 H    5.330400      0.3987000       1.132000    


%chk=000178719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178719

0 1
O 1.216238 2.892476 0.701494
C -1.994440 -0.349800 -0.830013
C -0.517109 0.023308 -0.681881
C -2.295632 -1.732215 -0.180676
C -3.016598 0.728629 -0.350632
C -0.092682 1.477789 -0.831821
C 0.441534 -0.962462 -0.656128
C 1.932542 -0.593278 -0.616138
C -2.300845 -1.655092 1.379126
C -1.268572 -2.756614 -0.628861
C -2.505194 2.153367 -0.510096
C 2.163743 0.738248 0.111532
C -1.206249 2.487386 -0.692685
C 1.118449 1.792091 0.080282
C 0.033722 -2.373710 -0.788207
C -3.479264 0.547818 1.095083
C -3.154363 -0.511009 1.877981
C 2.812449 -1.719002 0.004977
C 3.380800 1.012484 0.692114
C 4.217040 -1.262688 0.349734
C 4.469573 0.039776 0.689452
H -2.156775 -0.464424 -1.929109
H -3.311510 -2.039293 -0.498582
H -3.920927 0.627892 -0.992765
H 0.331438 1.590142 -1.863666
H 2.281334 -0.448686 -1.669015
H -1.258826 -1.538505 1.740734
H -2.663761 -2.617320 1.790636
H -1.565375 -3.807807 -0.727444
H -3.255996 2.949305 -0.407972
H -0.903505 3.539916 -0.730697
H 0.794705 -3.122946 -1.034461
H -4.105117 1.356038 1.498862
H -3.511794 -0.549845 2.916112
H 2.862927 -2.581246 -0.684041
H 2.328893 -2.097115 0.933716
H 3.523593 1.998897 1.150773
H 5.012428 -2.017472 0.395106
H 5.472024 0.357968 0.996775


