%chk=000081826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081826

0 1
 O   -1.386900       1.347400      0.8956000    
 O   -2.671600       1.226700      -1.006200    
 O    4.331600      0.7048000      0.3100000    
 N   -3.205000      -1.392500     -0.4409000    
 C   -1.948800     -0.8324000      9.0800002E-02
 C  -0.7957000      -1.380000     -0.7844000    
 C   0.5783000     -0.8211000     -0.4915000    
 C   -1.844500      -1.262600       1.560900    
 C   -2.075200      0.6863000     -8.0899999E-02
 C    1.005000      0.3132000      -1.161000    
 C    1.381400      -1.455400      0.4412000    
 C    2.272600      0.8285000     -0.8901000    
 C    2.648800     -0.9399000      0.7123000    
 C    3.094600      0.2019000      4.6500001E-02
 C   -1.384400       2.775300      0.7978000    
 H   -1.009600      -1.186600      -1.846400    
 H  -0.7536000      -2.476100     -0.7040000    
 H  -0.9474000     -0.8635000       2.045100    
 H   -2.702200     -0.8988000       2.139900    
 H   -1.813300      -2.354100       1.657200    
 H   -3.187000      -2.409500     -0.3672000    
 H   -3.285300      -1.185900      -1.436300    
 H   0.3746000      0.8083000      -1.894000    
 H    1.044700      -2.346200      0.9634000    
 H    2.614000       1.718200      -1.412100    
 H    3.279600      -1.437600       1.444000    
 H  -0.7944000       3.171300       1.628600    
 H   -2.405100       3.161400      0.8756000    
 H  -0.9215000       3.090000     -0.1424000    
 H    4.761400      0.1477000      0.9816000    


%chk=000081826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081826

0 1
O -1.598411 1.385474 0.975516
O -2.388049 1.188018 -1.198293
O 4.442816 0.749150 0.303820
N -3.294454 -1.364198 -0.378854
C -1.984265 -0.869324 0.097611
C -0.792639 -1.421299 -0.804521
C 0.594476 -0.877840 -0.505498
C -1.796514 -1.271621 1.571065
C -2.029115 0.655295 -0.118774
C 1.055739 0.318501 -1.120981
C 1.468786 -1.537687 0.394732
C 2.331542 0.846424 -0.842643
C 2.751406 -1.024005 0.686660
C 3.179284 0.174518 0.067457
C -1.558154 2.858402 0.790737
H -1.071501 -1.199995 -1.852363
H -0.810310 -2.521932 -0.679078
H -0.836121 -0.905474 1.965391
H -2.612961 -0.859823 2.185364
H -1.816461 -2.375507 1.657862
H -3.416949 -2.375695 -0.273987
H -3.549139 -1.014411 -1.308893
H 0.407217 0.836893 -1.838084
H 1.147175 -2.471382 0.872111
H 2.689511 1.762356 -1.322273
H 3.412349 -1.555864 1.384011
H -1.220948 3.250904 1.759798
H -2.560639 3.235946 0.529475
H -0.848624 3.117538 -0.012712
H 4.960051 0.205439 0.948443


