%chk=000062126.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062126

0 1
 O   -3.716700      0.7632000     -0.8250000    
 C    1.373900      -1.136200     -0.1578000    
 C   0.5228000      0.1489000     -0.2921000    
 C    2.588500     -0.9248000      0.7981000    
 C  -0.9033000     -3.1900000E-02 -0.7547000    
 C   0.5628000      -2.323500      0.4044000    
 C    1.897000      -1.522500      -1.559900    
 C    1.068300       1.366200     -4.9300000E-02
 C   -1.859500     -0.1225000      0.4300000    
 C    3.197800      0.4382000      0.7019000    
 C    2.476100       1.489000      0.2975000    
 C   -3.303100     -0.3458000     -3.1700000E-02
 C   0.3429000       2.682800     -0.1167000    
 C   -4.247400     -0.4811000       1.155200    
 H    3.361400      -1.675000      0.5878000    
 H    2.290400      -1.076500       1.844100    
 H  -0.9965000     -0.9149000      -1.396300    
 H   -1.189400      0.7991000      -1.410800    
 H  -0.2776000      -2.612200     -0.2339000    
 H    1.201800      -3.211600      0.4903000    
 H   0.1860000      -2.113400       1.410700    
 H    1.074700      -1.730800      -2.253700    
 H    2.505000     -0.7240000      -2.000400    
 H    2.519400      -2.423900      -1.514900    
 H   -1.808900      0.8109000       1.005500    
 H   -1.582400     -0.9286000       1.113300    
 H    4.236000      0.5684000      0.9895000    
 H    2.937300       2.470500      0.2460000    
 H   -3.361500      -1.247400     -0.6521000    
 H   0.4745000       3.238500      0.8189000    
 H  -0.7339000       2.583500     -0.2706000    
 H   0.7375000       3.292800     -0.9368000    
 H   -3.968300      -1.326000       1.791900    
 H   -5.276400     -0.6309000      0.8109000    
 H   -4.248900      0.4317000       1.761100    
 H   -4.626800      0.5896000      -1.120500    


%chk=000062126-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062126

0 1
O -3.557649 1.122682 -0.637362
C 1.470948 -1.184496 -0.136393
C 0.522082 0.041008 -0.250122
C 2.653865 -0.890645 0.836761
C -0.916486 -0.196100 -0.692568
C 0.755358 -2.457823 0.392249
C 2.024136 -1.475341 -1.567107
C 1.023108 1.314552 -0.074797
C -1.933073 -0.246046 0.484643
C 3.249203 0.490642 0.669304
C 2.448670 1.516029 0.260919
C -3.391955 -0.207541 0.003011
C 0.206408 2.587994 -0.243592
C -4.406005 -0.393689 1.145015
H 3.426863 -1.673666 0.705919
H 2.288583 -0.989463 1.885090
H -0.990783 -1.142914 -1.262415
H -1.252528 0.602373 -1.377164
H -0.059883 -2.793726 -0.273364
H 1.482678 -3.288868 0.466074
H 0.332619 -2.289392 1.400086
H 1.198596 -1.651585 -2.281456
H 2.621233 -0.621638 -1.933718
H 2.669166 -2.375789 -1.558884
H -1.769715 0.623930 1.148904
H -1.774749 -1.157503 1.091020
H 4.299576 0.660397 0.937076
H 2.846665 2.537537 0.187539
H -3.547247 -1.000361 -0.764309
H 0.267483 3.209107 0.671690
H -0.859287 2.403551 -0.449298
H 0.612885 3.204774 -1.070401
H -4.270840 -1.375867 1.634968
H -5.448325 -0.346019 0.774127
H -4.274539 0.396576 1.906012
H -4.493562 1.217123 -0.947555


