%chk=000097880.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097880

0 1
 O    2.035600     -6.0800001E-02 -1.0500000E-02
 O    3.598500       1.641000      4.9000001E-03
 C   -1.538100       1.129200     -5.3199999E-02
 C  -0.3575000      0.1600000     -2.9600000E-02
 C   -2.857600      0.4015000     -1.9900000E-02
 C   0.9733000      0.8988000     -1.7600000E-02
 C   -3.462700      3.2200001E-02  -1.212200    
 C   -3.446100      0.1121000       1.202400    
 C   -4.683700     -0.6415000      -1.181600    
 C   -4.667000     -0.5617000       1.233000    
 C   -5.285800     -0.9384000      4.0899999E-02
 C    3.292700      0.4590000      6.0000003E-04
 C    4.244600     -0.6726000      5.7999999E-03
 C    5.563100     -0.4375000      1.5799999E-02
 C    6.590800      -1.521300      2.1199999E-02
 H   -1.478900       1.817100      0.8002000    
 H   -1.489000       1.761900     -0.9489000    
 H  -0.3933000     -0.5115000     -0.8973000    
 H  -0.4132000     -0.4957000      0.8492000    
 H    1.062600       1.528900     -0.9104000    
 H    1.047900       1.527200      0.8776000    
 H   -3.000700      0.2571000      -2.169400    
 H   -2.971200      0.3994000       2.136300    
 H   -5.165300     -0.9355000      -2.109700    
 H   -5.135700     -0.7936000       2.184900    
 H   -6.236400      -1.463300      6.4800002E-02
 H    3.850700      -1.683300      1.0000000E-03
 H    5.943500      0.5806000      2.0400001E-02
 H    7.231900      -1.431000     -0.8611000    
 H    6.141900      -2.519500      1.6000001E-02
 H    7.218900      -1.434500      0.9131000    


%chk=000097880-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097880

0 1
O 2.040492 -0.090356 0.001444
O 3.616428 1.637192 -0.045016
C -1.572196 1.174877 -0.023079
C -0.370876 0.187884 0.002663
C -2.909742 0.449139 -0.008286
C 0.961823 0.936383 -0.018661
C -3.530177 0.046500 -1.219052
C -3.547102 0.123909 1.216832
C -4.752466 -0.662541 -1.208256
C -4.769549 -0.584898 1.233686
C -5.376921 -0.981641 0.019803
C 3.354716 0.406731 -0.015989
C 4.321469 -0.713231 0.005794
C 5.664099 -0.482078 -0.003952
C 6.729268 -1.543748 0.016263
H -1.498879 1.852704 0.850121
H -1.495381 1.808771 -0.928461
H -0.427940 -0.491279 -0.868137
H -0.426842 -0.444377 0.908151
H 1.080212 1.555715 -0.927990
H 1.086123 1.597306 0.860060
H -3.054277 0.296044 -2.176010
H -3.084722 0.433927 2.162658
H -5.218872 -0.961485 -2.153942
H -5.249375 -0.823399 2.189794
H -6.326170 -1.528854 0.030654
H 3.903135 -1.724858 0.029997
H 5.993197 0.567939 -0.028370
H 7.382646 -1.458401 -0.874076
H 6.303352 -2.560880 0.040401
H 7.388326 -1.418697 0.897658


