%chk=000107116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107116

0 1
 O  -0.3022000       1.094600     -0.1843000    
 O  -0.3838000      -1.266500     -2.1500001E-02
 C    1.788100     -0.1698000     -0.2836000    
 C    3.212200     -0.2972000     -0.9135000    
 C    3.675500     -0.1855000       1.270800    
 C    2.129900     -8.7600000E-02   1.252400    
 C    3.937500      -1.166000      0.1253000    
 C    1.007100       1.072700     -0.7553000    
 C   0.9209000      -1.411300     -0.5841000    
 C    3.979400      0.9868000     -0.6803000    
 C    4.239800       1.060900      0.6333000    
 C   -1.024500     -9.0700001E-02 -0.5147000    
 C   -2.393400      1.6000000E-03  0.1374000    
 C   -3.126700       1.278100     -0.2941000    
 C   -3.238500      -1.242300     -0.1912000    
 C   -4.488700       1.398100      0.3965000    
 C   -4.687000      -1.081000      0.1644000    
 C   -5.245400      0.1048000      0.4425000    
 H    3.257000     -0.6754000      -1.936100    
 H    4.125200     -0.4551000       2.226900    
 H    1.696500     -0.9300000       1.803800    
 H    1.779200      0.8410000       1.717000    
 H    5.004600      -1.305800     -9.3800001E-02
 H    3.487800      -2.150000      0.2862000    
 H    1.497200       2.003700     -0.4539000    
 H   0.9200000       1.091200      -1.848900    
 H   0.8254000      -1.569900      -1.665700    
 H    1.349900      -2.325700     -0.1645000    
 H    4.209500       1.734200      -1.422500    
 H    4.724200       1.876300       1.146000    
 H   -1.133900     -0.1599000      -1.606000    
 H   -2.258100      4.4399999E-02   1.228500    
 H   -3.271800       1.269500      -1.382800    
 H   -2.540800       2.174800     -6.1900001E-02
 H   -2.841600      -2.106000      0.3556000    
 H   -3.174800      -1.482500      -1.259800    
 H   -5.088100       2.151800     -0.1269000    
 H   -4.351400       1.754400       1.424500    
 H   -5.300200      -1.976800      0.1958000    
 H   -6.296700      0.1463000      0.7120000    


%chk=000107116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107116

0 1
O -0.293396 1.122688 -0.167536
O -0.396086 -1.282666 -0.035863
C 1.831846 -0.176505 -0.261853
C 3.276060 -0.302566 -0.924373
C 3.751125 -0.217709 1.302053
C 2.174979 -0.113211 1.271423
C 3.991675 -1.215143 0.124860
C 1.061281 1.068766 -0.756999
C 0.953871 -1.402684 -0.622121
C 4.008292 1.023011 -0.663818
C 4.290879 1.072644 0.671046
C -1.059580 -0.070423 -0.526208
C -2.443257 0.020545 0.115521
C -3.208400 1.278801 -0.364803
C -3.270928 -1.258684 -0.170183
C -4.546173 1.428312 0.396950
C -4.729937 -1.089477 0.212230
C -5.301335 0.113408 0.485648
H 3.259889 -0.649191 -1.970461
H 4.167341 -0.487466 2.284498
H 1.712861 -0.957934 1.812894
H 1.805443 0.815184 1.738289
H 5.061179 -1.355688 -0.104618
H 3.510938 -2.198317 0.275431
H 1.552369 2.001028 -0.440745
H 0.976927 1.054076 -1.868740
H 0.865058 -1.490809 -1.729885
H 1.357739 -2.343393 -0.216339
H 4.175236 1.805119 -1.409426
H 4.731724 1.904963 1.226697
H -1.111124 -0.131322 -1.644574
H -2.282036 0.103278 1.208827
H -3.416667 1.182552 -1.450573
H -2.580374 2.176121 -0.226703
H -2.828772 -2.113765 0.373834
H -3.196508 -1.522323 -1.248546
H -5.180339 2.189401 -0.100515
H -4.357484 1.817066 1.420439
H -5.336649 -2.004088 0.273425
H -6.358367 0.156600 0.784318


