%chk=000177954.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177954

0 1
 O    1.701200       1.060900      0.7565000    
 O    1.653500      -2.689900      -1.116400    
 O    1.442200      -3.168700       1.751100    
 O    1.790200       3.396800      -1.762800    
 O   -1.402600       1.697400       2.201100    
 O  -0.5395000      -2.897300      -1.792300    
 C    2.941800      0.6641000      0.1376000    
 C    2.726800     -0.5743000     -0.7634000    
 C    3.332600       1.896800     -0.6881000    
 C    2.343500      -1.916000     -9.7900003E-02
 C   0.9034000       1.761400     -0.2174000    
 C    1.982100       2.469100     -0.9882000    
 C    1.358200      -1.924500       1.058500    
 C    3.980900      0.3993000       1.226100    
 C  -8.0700003E-02   2.684300      0.4698000    
 C   6.7199998E-02  -1.887000      0.3264000    
 C   -3.088000      0.1789000      0.3881000    
 C   -2.310500       1.444300     -2.5800001E-02
 C   -1.271400       1.900600      0.9936000    
 C   -2.358200      -1.143300      4.5100000E-02
 C   0.2971000      -2.529000     -0.9893000    
 C   -1.060700      -1.324300      0.7782000    
 C   -4.427400      0.1709000     -0.2945000    
 C   -4.405500      0.1396000      -1.793900    
 C   -5.576100      0.1899000      0.3977000    
 H    3.649400     -0.7580000      -1.332900    
 H    1.984400     -0.3430000      -1.537900    
 H    3.882800       1.651300      -1.599000    
 H    3.880900       2.636700     -9.6199997E-02
 H    3.252900      -2.467200      0.1686000    
 H   0.4142000       1.036000     -0.8727000    
 H    1.502800      -1.126800       1.786700    
 H    4.955700      0.1522000      0.7934000    
 H    4.100800       1.277400       1.871300    
 H    3.681000     -0.4179000       1.888500    
 H  -0.4601000       3.455100     -0.2100000    
 H   0.3877000       3.198200       1.317600    
 H   -3.246200      0.1986000       1.475100    
 H   -2.989100       2.299000     -0.1463000    
 H   -1.816000       1.284300     -0.9898000    
 H   -2.172900      -1.193200      -1.032200    
 H   -3.006700      -1.990100      0.3056000    
 H   -1.043000     -0.9410000       1.797000    
 H   0.7886000      -3.147700       2.471200    
 H   -3.816200      0.9621000      -2.209300    
 H   -4.007800     -0.8068000      -2.170700    
 H   -5.415900      0.2410000      -2.207400    
 H   -6.537800      0.1829000     -0.1045000    
 H   -5.583500      0.2123000       1.482400    


%chk=000177954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177954

0 1
O 1.726663 1.041747 0.803076
O 1.634788 -2.606841 -1.271354
O 1.641619 -3.140833 1.736652
O 1.873216 3.559872 -1.729280
O -1.459883 1.649228 2.189302
O -0.596199 -2.834185 -1.905778
C 3.058345 0.661626 0.182530
C 2.854912 -0.545520 -0.771794
C 3.421827 1.937627 -0.629190
C 2.383575 -1.894647 -0.168190
C 0.981239 1.810789 -0.203562
C 2.074905 2.586757 -0.971528
C 1.378116 -1.873893 1.010220
C 4.018996 0.378223 1.340580
C -0.090721 2.687106 0.465170
C 0.038703 -1.869577 0.305292
C -3.145342 0.142657 0.357172
C -2.260431 1.337746 -0.106072
C -1.279100 1.853974 0.960241
C -2.445532 -1.235727 0.110155
C 0.235854 -2.473488 -1.049425
C -1.113557 -1.340511 0.809439
C -4.529665 0.180687 -0.300515
C -4.604092 -0.001574 -1.808046
C -5.644555 0.382366 0.451290
H 3.805956 -0.728132 -1.307187
H 2.125960 -0.261036 -1.554825
H 4.007641 1.749112 -1.545169
H 3.999970 2.644457 -0.003424
H 3.226033 -2.552814 0.094663
H 0.494512 1.126318 -0.937437
H 1.492917 -1.009870 1.681292
H 5.032022 0.167636 0.952681
H 4.074241 1.252426 2.011728
H 3.695672 -0.490157 1.938469
H -0.427902 3.419687 -0.295135
H 0.353615 3.225200 1.319099
H -3.283716 0.262998 1.449738
H -2.915338 2.205895 -0.337705
H -1.722235 1.111936 -1.047319
H -2.325102 -1.448267 -0.966197
H -3.121939 -2.022012 0.507900
H -1.071630 -0.910863 1.823064
H 0.880433 -3.322434 2.344923
H -3.960720 0.727805 -2.338161
H -4.259504 -1.007700 -2.113873
H -5.636497 0.126714 -2.174662
H -6.643117 0.424005 0.000359
H -5.588851 0.510887 1.539091


