%chk=000176537.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176537

0 1
 O    2.030900       1.791000       1.212800    
 O    4.188700       2.468300     -0.3870000    
 C    2.104400       1.255900     -0.1102000    
 C    3.566700       1.201300     -0.5694000    
 C    1.433000     -0.1070000     -7.5199999E-02
 C    4.332300      0.1541000      0.2245000    
 C    3.745300      -1.225400     -4.4900000E-02
 C    2.235100      -1.270700     -1.1500000E-02
 C   5.7000001E-03 -0.2223000     -5.1600002E-02
 C  -0.5771000      -1.511800     -2.0000001E-03
 C    1.625400      -2.528700      2.9999999E-02
 C   0.2400000      -2.646700      3.4100000E-02
 C  -0.8803000      0.8834000     -6.9899999E-02
 C   -1.974700      -1.662000      1.4900000E-02
 C   -2.280000      0.7375000     -5.0999999E-02
 C   -2.834500     -0.5552000     -9.8000001E-03
 C   -3.137400       1.851000     -7.2099999E-02
 C   -4.231600     -0.7070000      7.6000001E-03
 C   -4.522700       1.686300     -5.4499999E-02
 C   -5.069300      0.4080000     -1.4900000E-02
 H    1.572100       1.940500     -0.7795000    
 H    3.608100      0.9606000      -1.639300    
 H    4.290200      0.3860000       1.296700    
 H    5.396800      0.1671000     -3.8699999E-02
 H    4.154400      -1.929100      0.6903000    
 H    4.068500      -1.563100      -1.038000    
 H    2.231700      -3.431200      5.8200002E-02
 H  -0.1954000      -3.643600      6.9399998E-02
 H  -0.4810000       1.896200     -9.4999999E-02
 H   -2.403900      -2.663900      5.0600000E-02
 H    2.478300       2.654400       1.201800    
 H    5.104200       2.395400     -0.7065000    
 H   -2.731300       2.860100     -0.1034000    
 H   -4.679400      -1.698100      3.9500002E-02
 H   -5.173100       2.555900     -7.1699999E-02
 H   -6.147400      0.2774000     -1.0000000E-03


%chk=000176537-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176537

0 1
O 1.926991 1.949784 1.066130
O 4.053543 2.569045 -0.406013
C 2.082189 1.233913 -0.218760
C 3.577287 1.181371 -0.597670
C 1.463363 -0.150368 -0.091309
C 4.325824 0.168856 0.277222
C 3.785486 -1.240963 -0.039996
C 2.261314 -1.299861 -0.031147
C 0.014159 -0.264427 -0.055071
C -0.596513 -1.589707 -0.014454
C 1.639975 -2.599848 0.024493
C 0.261606 -2.745311 0.020925
C -0.836702 0.869049 -0.046229
C -2.006738 -1.716134 0.000654
C -2.248862 0.744929 -0.028230
C -2.854359 -0.582053 -0.012469
C -3.113190 1.898136 -0.019107
C -4.291047 -0.692352 0.001711
C -4.497498 1.754750 -0.004671
C -5.093436 0.444779 0.004141
H 1.554669 1.807854 -1.011493
H 3.676743 0.898014 -1.667485
H 4.146316 0.418689 1.339828
H 5.417169 0.212063 0.088116
H 4.184904 -1.973825 0.686293
H 4.154978 -1.565371 -1.036424
H 2.285504 -3.485892 0.068445
H -0.193613 -3.742209 0.055502
H -0.397279 1.870717 -0.010752
H -2.451080 -2.719276 0.028867
H 2.550131 2.726443 1.003347
H 5.041128 2.589563 -0.446897
H -2.658363 2.895803 -0.023360
H -4.743231 -1.691498 0.012592
H -5.143683 2.639485 0.001336
H -6.184984 0.350454 0.015237


