%chk=000078723.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078723

0 1
 O   0.7832000      0.3270000      -2.011900    
 O    2.297600       2.521600     -0.1279000    
 O    3.373800       1.454900      -1.822100    
 C   -1.822100      0.2177000     -6.8400003E-02
 C  -0.9269000     -0.6330000     -0.7373000    
 C   -3.159800     -0.2012000      0.1266000    
 C   0.4673000     -0.2708000     -0.9759000    
 C    1.550900     -0.5972000     -4.9999999E-03
 C   -1.344400      -1.878800      -1.206900    
 C   -1.419300       1.474700      0.4111000    
 C   -3.563000      -1.458100     -0.3531000    
 C   -4.055200      0.6494000      0.7952000    
 C   -2.660100      -2.290400      -1.015400    
 C    2.656300      0.2187000      9.6400000E-02
 C   -2.322200       2.306700       1.073500    
 C    1.393500      -1.728800      0.7671000    
 C   -3.637700       1.894900       1.265300    
 C    3.653300     -0.1120000       1.014200    
 C    2.390700      -2.059300       1.684700    
 C    3.520500      -1.250900       1.808300    
 C    2.823800       1.415000     -0.7185000    
 H  -0.6548000      -2.537900      -1.728800    
 H  -0.4036000       1.837500      0.2810000    
 H   -4.586500      -1.800300     -0.2147000    
 H   -5.088200      0.3481000      0.9562000    
 H   -2.985000      -3.259700      -1.382200    
 H   -1.998100       3.276800       1.439000    
 H   0.5347000      -2.386300      0.6967000    
 H   -4.340200       2.543300       1.780800    
 H    4.538700      0.5099000       1.119800    
 H    2.288600      -2.947000       2.302300    
 H    4.297000      -1.508700       2.522600    
 H    2.412200       3.321700     -0.6837000    


%chk=000078723-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078723

0 1
O 1.127304 -0.721166 -2.281108
O 1.762640 1.987942 -1.333155
O 4.069951 1.695643 -1.309109
C -1.682935 0.039089 -0.034645
C -0.901683 -0.735126 -0.977339
C -3.103616 -0.242552 0.077935
C 0.587222 -0.609225 -1.139597
C 1.473930 -0.515585 0.084255
C -1.535983 -1.679069 -1.804491
C -1.142224 1.113408 0.749727
C -3.696762 -1.246710 -0.755268
C -3.902043 0.508089 1.004052
C -2.930694 -1.941751 -1.693948
C 2.651996 0.287442 0.102719
C -1.947834 1.832180 1.636331
C 1.237891 -1.409683 1.157894
C -3.336526 1.521459 1.778349
C 3.588362 0.148394 1.154399
C 2.168409 -1.534405 2.212961
C 3.352641 -0.763227 2.205877
C 2.935143 1.340687 -0.918736
H -0.924909 -2.225185 -2.530658
H -0.093394 1.394582 0.627064
H -4.769330 -1.451123 -0.652512
H -4.971567 0.278834 1.082404
H -3.392673 -2.696696 -2.338371
H -1.514725 2.650438 2.221865
H 0.333519 -2.026980 1.149151
H -3.953328 2.091968 2.481064
H 4.490979 0.767886 1.138574
H 1.974818 -2.238777 3.029025
H 4.081980 -0.863681 3.016439
H 1.978440 2.640401 -2.052150


