%chk=000137918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137918

0 1
 O    3.834400      0.7332000       1.261100    
 C    1.161100      0.2096000      4.0600002E-02
 C    2.395500     -0.6958000     -7.2499998E-02
 C  -0.1306000     -0.6051000     -7.3299997E-02
 C    3.743800      5.0400000E-02  8.8999998E-03
 C   -1.399600      0.2497000      3.4000000E-03
 C   -2.725400     -0.5125000     -8.2400002E-02
 C   -3.955700      0.3860000      5.7000000E-02
 C    3.899600       1.096700      -1.095500    
 C    4.899700     -0.9527000     -6.3800000E-02
 C   -5.247900     -0.4255000     -4.4399999E-02
 C   -6.475000      0.4660000      6.0899999E-02
 H    1.173900      0.7446000      0.9971000    
 H    1.168100      0.9615000     -0.7556000    
 H    2.346100      -1.432900      0.7401000    
 H    2.346600      -1.255900      -1.015100    
 H  -0.1323000      -1.155200      -1.022400    
 H  -0.1576000      -1.354600      0.7272000    
 H   -1.371200      0.9949000     -0.8019000    
 H   -1.381800      0.8132000      0.9451000    
 H   -2.746400      -1.277400      0.7038000    
 H   -2.767400      -1.043700      -1.041300    
 H   -3.922100      0.9085000       1.020500    
 H   -3.938200       1.152200     -0.7274000    
 H    3.189800       1.921500     -0.9732000    
 H    3.764500      0.6574000      -2.089100    
 H    4.894800       1.555400      -1.055900    
 H    4.833000      -1.686100      0.7480000    
 H    5.864500     -0.4470000      5.7399999E-02
 H    4.906600      -1.491400      -1.017000    
 H   -5.276600     -0.9630000     -0.9994000    
 H   -5.278800      -1.177600      0.7526000    
 H    3.736300      7.4100003E-02   1.969500    
 H   -7.387200     -0.1344000     -1.2800000E-02
 H   -6.493600      0.9961000       1.018600    
 H   -6.490900       1.208300     -0.7435000    


%chk=000137918-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137918

0 1
O 3.800235 0.638438 1.376807
C 1.173215 0.198168 -0.122502
C 2.420614 -0.708372 -0.197190
C -0.145255 -0.607370 -0.094589
C 3.779217 0.015909 0.019506
C -1.405828 0.285816 -0.063611
C -2.724889 -0.518351 -0.018342
C -3.986845 0.373215 0.006163
C 3.983337 1.203767 -0.936603
C 4.947040 -0.991054 -0.089623
C -5.305246 -0.432611 0.056694
C -6.560914 0.465779 0.078912
H 1.244449 0.832130 0.783584
H 1.156730 0.887254 -0.990573
H 2.331359 -1.507007 0.571988
H 2.446236 -1.227436 -1.177471
H -0.191844 -1.274587 -0.981466
H -0.148705 -1.273906 0.793889
H -1.409485 0.945428 -0.956641
H -1.355892 0.958667 0.817932
H -2.723134 -1.174610 0.877396
H -2.771540 -1.194748 -0.897771
H -3.940414 1.052041 0.883570
H -3.992489 1.027065 -0.891168
H 3.229163 1.985539 -0.749033
H 3.904117 0.876961 -1.989129
H 4.980723 1.648982 -0.776965
H 4.800978 -1.845683 0.599911
H 5.899219 -0.495262 0.168707
H 5.031041 -1.397340 -1.114504
H -5.350009 -1.111992 -0.819156
H -5.298644 -1.084297 0.954414
H 3.713153 -0.086822 2.048487
H -7.489327 -0.133494 0.117332
H -6.553355 1.134626 0.960379
H -6.607009 1.103655 -0.824035


