%chk=000106587.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106587

0 1
 O    9.425300     -0.4678000     -0.2059000    
 O    8.208300       1.445700     -6.6500001E-02
 N    5.861600      0.1640000      2.7000001E-02
 C   -1.704800      0.3276000      9.5100001E-02
 C   -3.014800     -0.4601000     -1.4600000E-02
 C  -0.4215000     -0.5094000      0.1002000    
 C   -4.261200      0.4264000      4.2300001E-02
 C   0.8566000      0.3329000      0.1267000    
 C   -5.569900     -0.3614000     -7.4800000E-02
 C    2.102800     -0.5553000      0.1631000    
 C   -6.816100      0.5265000     -4.1999999E-02
 C    3.414500      0.2349000      0.1188000    
 C   -8.095200     -0.3124000     -8.8000000E-02
 C    4.655700     -0.6561000      7.7000000E-02
 C   -9.341600      0.5696000     -1.6799999E-02
 C   -10.61450     -0.2580000     -9.6100003E-02
 C    7.052500     -0.6695000     -5.1899999E-02
 C    8.262200      0.2227000     -9.3500003E-02
 H   -1.657200       1.038900     -0.7394000    
 H   -1.730500      0.9297000       1.012200    
 H   -3.058500      -1.195000      0.7985000    
 H   -3.013600      -1.026500     -0.9539000    
 H  -0.4377000      -1.177300      0.9703000    
 H  -0.4123000      -1.150200     -0.7902000    
 H   -4.262300      0.9878000      0.9847000    
 H   -4.213700       1.165500     -0.7669000    
 H   0.8878000      0.9767000     -0.7604000    
 H   0.8490000      0.9900000       1.004300    
 H   -5.620100      -1.088500      0.7453000    
 H   -5.561900     -0.9372000      -1.008500    
 H    2.084500      -1.172100       1.070100    
 H    2.076100      -1.245500     -0.6896000    
 H   -6.807700       1.132400      0.8721000    
 H   -6.795200       1.220300     -0.8909000    
 H    3.404600      0.8862000     -0.7649000    
 H    3.462800      0.8933000      0.9957000    
 H   -8.101700      -1.022200      0.7483000    
 H   -8.112600     -0.9023000      -1.012500    
 H    4.602000      -1.308500     -0.8030000    
 H    4.671200      -1.293300      0.9693000    
 H   -9.332900       1.293600     -0.8398000    
 H   -9.340500       1.141200      0.9186000    
 H    5.819200      0.7773000     -0.7870000    
 H   -10.66980     -0.9728000      0.7311000    
 H   -10.66190     -0.8161000      -1.036700    
 H   -11.49320      0.3923000     -4.2399999E-02
 H    7.042500      -1.279300     -0.9616000    
 H    7.134800      -1.310700      0.8320000    
 H    10.20250      0.1292000     -0.2503000    


%chk=000106587-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000106587

0 1
O 9.573398 -0.318635 0.153259
O 8.283622 1.470106 -0.582569
N 5.933030 0.101930 0.149355
C -1.705515 0.348139 0.030991
C -3.023387 -0.457127 -0.023799
C -0.442344 -0.540965 -0.013547
C -4.287047 0.431692 0.013154
C 0.875216 0.262860 0.063285
C -5.604877 -0.374359 -0.031222
C 2.137709 -0.626203 0.000638
C -6.868680 0.514565 0.003089
C 3.450985 0.178924 0.115348
C -8.186843 -0.291160 -0.038767
C 4.708321 -0.706567 0.022458
C -9.450393 0.598883 -0.002642
C -10.762536 -0.213985 -0.047289
C 7.187795 -0.643125 0.073887
C 8.355909 0.299252 -0.149887
H -1.678804 1.065272 -0.816144
H -1.689550 0.961105 0.956586
H -3.052195 -1.169656 0.827229
H -3.037292 -1.075222 -0.946094
H -0.476705 -1.267558 0.825277
H -0.451207 -1.143362 -0.946240
H -4.269885 1.054654 0.932096
H -4.261938 1.139780 -0.841660
H 0.904443 0.999355 -0.766896
H 0.889548 0.853655 1.002883
H -5.630844 -1.080703 0.825038
H -5.621452 -0.999257 -0.948876
H 2.095507 -1.377225 0.817107
H 2.133995 -1.199062 -0.950397
H -6.851325 1.140543 0.920040
H -6.843609 1.219958 -0.854030
H 3.483417 0.943885 -0.689704
H 3.477425 0.729552 1.075582
H -8.213180 -0.997231 0.817772
H -8.206536 -0.916327 -0.956226
H 4.677170 -1.291818 -0.934346
H 4.692840 -1.451157 0.844723
H -9.422118 1.305389 -0.857375
H -9.430175 1.221613 0.915203
H 5.944734 0.942521 -0.442955
H -10.827284 -0.908386 0.811829
H -10.821683 -0.819542 -0.971559
H -11.650204 0.444595 -0.017278
H 7.225847 -1.388848 -0.765592
H 7.369668 -1.221891 0.999606
H 10.320626 0.308344 -0.046740


