%chk=000111776.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111776

0 1
 O    2.127100       1.116700      0.4500000    
 C    5.541100     -0.4002000     -0.1694000    
 C    4.430700      0.6509000     -9.6000005E-03
 C    3.072600      5.9099998E-02  0.3482000    
 C    5.693000      -1.197200       1.128200    
 C    5.276100      -1.355000      -1.334200    
 C   0.8254000      0.8116000      0.1504000    
 C   -1.816600      0.1942000     -0.4575000    
 C   -4.258700     -9.1000004E-03  5.9099998E-02
 C  -6.3000000E-03   1.792000     -0.3789000    
 C   0.3493000     -0.4745000      0.3786000    
 C   -3.198500     -0.1297000     -0.7749000    
 C   -5.675400     -0.4055000     -0.2975000    
 C   -1.331800       1.482200     -0.6837000    
 C  -0.9761000     -0.7842000      7.3600002E-02
 C   -4.064600      0.5024000       1.463200    
 C   -5.987400      -1.853500      5.4400001E-02
 H    6.480600      0.1312000     -0.3656000    
 H    4.338700       1.234000     -0.9351000    
 H    4.717800       1.377600      0.7618000    
 H    2.785000     -0.6492000     -0.4367000    
 H    3.110700     -0.4542000       1.314100    
 H    6.591300      -1.823200       1.080400    
 H    4.846100      -1.866200       1.310800    
 H    5.802700     -0.5311000       1.990400    
 H    4.415100      -2.005600      -1.152000    
 H    6.144600      -2.002300      -1.498700    
 H    5.096600     -0.7985000      -2.260000    
 H   0.3676000       2.796200     -0.5567000    
 H   0.9610000      -1.256700      0.8174000    
 H   -3.357100     -0.5187000      -1.778200    
 H   -6.388000      0.2641000      0.1983000    
 H   -5.829900     -0.2663000      -1.374900    
 H   -1.974400       2.255700      -1.097300    
 H   -1.341600      -1.791100      0.2614000    
 H   -4.674500       1.399400       1.616900    
 H   -4.387200     -0.2554000       2.185100    
 H   -3.035900      0.7690000       1.717000    
 H   -5.892000      -2.029800       1.130800    
 H   -7.012900      -2.100200     -0.2382000    
 H   -5.312500      -2.541900     -0.4652000    


%chk=000111776-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111776

0 1
O 2.194414 0.858058 0.254449
C 5.842995 -0.330009 0.080117
C 4.581975 0.551414 0.312506
C 3.252468 -0.135631 -0.016203
C 5.857439 -1.592969 0.976825
C 6.039263 -0.703733 -1.410425
C 0.862709 0.466807 0.045531
C -1.926544 -0.117758 -0.297372
C -4.499220 0.024840 -0.014594
C -0.117362 1.453375 0.318183
C 0.457143 -0.809725 -0.419420
C -3.335595 -0.502954 -0.515361
C -5.836977 -0.592331 -0.414908
C -1.482440 1.166277 0.148533
C -0.916404 -1.078631 -0.589397
C -4.581977 1.188344 0.961441
C -6.491134 -1.428483 0.718716
H 6.709008 0.296981 0.378995
H 4.655861 1.469770 -0.301668
H 4.549321 0.875265 1.370878
H 3.202958 -0.441713 -1.080875
H 3.085714 -1.027818 0.620492
H 6.826779 -2.118554 0.895330
H 5.068417 -2.310477 0.682245
H 5.699738 -1.332182 2.040097
H 5.247181 -1.389129 -1.766853
H 7.008223 -1.214906 -1.560714
H 6.025191 0.195037 -2.054914
H 0.215834 2.441201 0.651925
H 1.189740 -1.588094 -0.652366
H -3.453040 -1.380465 -1.171438
H -6.540172 0.214276 -0.711039
H -5.700989 -1.237438 -1.303587
H -2.207031 1.963101 0.331219
H -1.219485 -2.068965 -0.952273
H -4.561617 2.163579 0.433737
H -5.528732 1.153491 1.529923
H -3.749409 1.185634 1.686809
H -6.657013 -0.821549 1.627854
H -7.471278 -1.826930 0.397237
H -5.844256 -2.280005 0.996164


