%chk=000108622.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108622

0 1
 O    1.614200      0.3230000     -3.4499999E-02
 O   0.3740000      -1.621600     -6.7400001E-02
 O   -4.697000      -1.116100      9.9200003E-02
 C   -2.069800     -0.1609000     -3.7000000E-03
 C    4.009200      0.5045000      2.9999999E-02
 C  -0.7190000      0.5514000     -6.2500000E-02
 C   -3.246400      0.8157000     -1.5600000E-02
 C    5.334900     -0.2512000      4.9800001E-02
 C    2.820900     -0.4461000     -1.8000000E-03
 C   0.4561000     -0.4010000     -6.5499999E-02
 C    6.519500      0.7017000      3.7900001E-02
 C   -4.589100      0.1075000      3.4899998E-02
 C   -5.807600      0.9932000     -1.0000000E-03
 H   -2.115900     -0.7837000      0.8990000    
 H   -2.156700     -0.8511000     -0.8530000    
 H    3.930300       1.157700      0.9080000    
 H    3.963700       1.168800     -0.8421000    
 H  -0.6631000       1.157600     -0.9737000    
 H  -0.6198000       1.210600      0.8076000    
 H   -3.184100       1.484700      0.8497000    
 H   -3.217500       1.420400     -0.9287000    
 H    5.399800     -0.9133000     -0.8215000    
 H    5.389300     -0.8842000      0.9431000    
 H    2.868700      -1.080000     -0.8950000    
 H    2.821700      -1.080300      0.8925000    
 H    6.512500       1.325400     -0.8616000    
 H    6.502300       1.359600      0.9127000    
 H    7.458400      0.1395000      5.4000001E-02
 H   -6.711500      0.3797000      4.7499999E-02
 H   -5.817700       1.564600     -0.9323000    
 H   -5.793900       1.669700      0.8571000    


%chk=000108622-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108622

0 1
O 1.624623 0.317201 -0.003775
O 0.393328 -1.661573 -0.049518
O -4.799040 -1.140282 0.132137
C -2.114031 -0.205508 0.008360
C 4.052866 0.492897 0.019972
C -0.763629 0.533081 -0.037728
C -3.294674 0.780738 -0.023555
C 5.416247 -0.239248 0.024691
C 2.883624 -0.490818 -0.003234
C 0.429372 -0.410796 -0.030318
C 6.609247 0.739796 0.046234
C -4.671332 0.108329 0.036612
C -5.883365 1.034423 -0.016941
H -2.174223 -0.831845 0.915704
H -2.189688 -0.910137 -0.838263
H 3.970732 1.137589 0.916089
H 3.988412 1.158696 -0.862040
H -0.686055 1.166349 -0.944240
H -0.654297 1.226996 0.818805
H -3.232080 1.499613 0.821704
H -3.261518 1.409271 -0.939220
H 5.488237 -0.890900 -0.869549
H 5.471609 -0.910659 0.905354
H 2.889886 -1.128995 -0.906462
H 2.873982 -1.152068 0.883142
H 6.595123 1.401675 -0.839748
H 6.578832 1.382853 0.945608
H 7.573041 0.199412 0.049386
H -6.812081 0.447927 0.052386
H -5.886729 1.614098 -0.959616
H -5.850018 1.767683 0.811123


