%chk=000127514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127514

0 1
 O   -3.446500      0.8331000     -0.7218000    
 O  -0.8704000       1.874100       2.485300    
 O    3.729700       1.861900     -0.4168000    
 O   -2.827900      -1.087300       2.220800    
 O   -4.936800      -1.745500       1.687800    
 C   -1.338300       1.866700      -1.126900    
 C   -2.750400       2.085100     -0.5935000    
 C  -0.5411000       1.449900      0.1181000    
 C   -1.105900       2.388800       1.185800    
 C   -2.607000       2.449700      0.8852000    
 C   -1.521300      0.7870000      -2.167100    
 C   -2.735900      8.8799998E-02  -1.652100    
 C   0.9348000       1.584500     -7.2300002E-02
 C   -3.104000      -1.153000      -1.981500    
 C    1.792700      0.5684000      8.5000001E-02
 C   -4.331400      -1.834600      -1.449800    
 C    3.255800      0.7692000     -0.1136000    
 C   -3.965900      -3.086200     -0.6455000    
 C    4.140300     -0.4450000      8.8799998E-02
 C   -3.069600      -2.770600      0.5486000    
 C    5.623400     -0.1164000     -5.9700001E-02
 C    6.519700      -1.343600      0.1275000    
 C    7.994700     -0.9857000     -5.7999998E-02
 C   -3.726000      -1.832600       1.530200    
 C    8.887500      -2.206800      9.5600002E-02
 H  -0.9271000       2.788000      -1.558300    
 H   -3.304000       2.844400      -1.157200    
 H  -0.7760000      0.4132000      0.4005000    
 H  -0.6606000       3.389300       1.118800    
 H   -3.183300       1.779900       1.533100    
 H   -2.968500       3.468100       1.067600    
 H   -1.742600       1.231500      -3.143800    
 H  -0.6509000      0.1314000      -2.260200    
 H    1.302800       2.570200     -0.3476000    
 H   -1.315700       2.464000       3.117200    
 H   -2.503400      -1.710100      -2.696600    
 H    1.455900     -0.4251000      0.3598000    
 H   -4.954400      -1.158000     -0.8561000    
 H   -4.949100      -2.136300      -2.304600    
 H   -3.454800      -3.809000      -1.293600    
 H   -4.890100      -3.568000     -0.3038000    
 H    3.951700     -0.8450000       1.091700    
 H    3.852800      -1.201700     -0.6500000    
 H   -2.838700      -3.696400       1.087600    
 H   -2.118400      -2.340700      0.2175000    
 H    5.803600      0.3150000      -1.052700    
 H    5.903200      0.6538000      0.6703000    
 H    6.363700      -1.763200       1.128600    
 H    6.235100      -2.117200     -0.5960000    
 H    8.289300     -0.2284000      0.6777000    
 H    8.150800     -0.5508000      -1.052100    
 H    8.639900      -2.970000     -0.6491000    
 H    9.937300      -1.928200     -3.9500002E-02
 H    8.778800      -2.649300       1.090900    
 H   -3.265800     -0.4777000       2.852300    


%chk=000127514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127514

0 1
O -3.682647 1.087524 -1.209177
O -1.249381 1.307683 2.396677
O 3.664697 2.030656 -0.155322
O -1.539527 -1.228552 1.715963
O -3.843159 -0.969365 1.833218
C -1.417852 1.975782 -1.266569
C -2.874849 2.276027 -0.792403
C -0.686924 1.430885 0.003035
C -1.381581 2.161518 1.185585
C -2.857127 2.382407 0.752242
C -1.602852 0.890282 -2.363539
C -2.835461 0.151077 -1.869995
C 0.804632 1.615162 -0.036362
C -3.167014 -1.165468 -1.920381
C 1.718865 0.609519 0.060133
C -4.393234 -1.742302 -1.240629
C 3.190786 0.865011 0.000380
C -4.105478 -2.990939 -0.354594
C 4.087672 -0.366845 0.132165
C -2.869349 -2.869751 0.569155
C 5.595470 -0.068599 0.071900
C 6.457335 -1.348274 0.140752
C 7.975072 -1.059190 0.086869
C -2.841459 -1.612373 1.425647
C 8.834429 -2.340871 0.136400
H -0.919060 2.882301 -1.652721
H -3.329779 3.150346 -1.287671
H -0.923057 0.353706 0.099424
H -0.875358 3.124834 1.397114
H -3.491164 1.574223 1.161824
H -3.253766 3.349960 1.106806
H -1.792701 1.367561 -3.344640
H -0.723475 0.232796 -2.463295
H 1.190228 2.640919 -0.159806
H -1.707562 1.730306 3.163307
H -2.499851 -1.837073 -2.476238
H 1.387529 -0.428822 0.199929
H -4.848671 -0.953815 -0.617358
H -5.154917 -2.031687 -1.994187
H -3.949242 -3.881569 -0.995930
H -5.006814 -3.187902 0.255557
H 3.824499 -0.881190 1.081833
H 3.798321 -1.082501 -0.668457
H -2.833375 -3.742958 1.252004
H -1.933017 -2.890999 -0.013995
H 5.817958 0.488275 -0.858790
H 5.864959 0.615054 0.900106
H 6.226626 -1.905474 1.073466
H 6.186751 -2.023545 -0.698639
H 8.248847 -0.394623 0.931397
H 8.204232 -0.493614 -0.839197
H 8.602160 -3.006654 -0.716381
H 9.914208 -2.106753 0.097778
H 8.645111 -2.909898 1.066404
H -1.488985 -0.298609 2.151704


