%chk=000039362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039362

0 1
 O   -2.280900     -6.2000002E-03 -0.6527000    
 O   -3.873300     -0.2681000      -2.294500    
 C    2.131300      1.2300000E-02 -0.1127000    
 C   0.9117000     -0.2630000     -0.7681000    
 C    3.089000      -1.032200      2.2500001E-02
 C    2.389000       1.311900      0.3995000    
 C  -4.0700000E-02  0.7498000     -0.9104000    
 C    1.398600       2.343400      0.2451000    
 C   0.1833000       2.039200     -0.4171000    
 C    2.821300      -2.324200     -0.4921000    
 C    4.318100     -0.7890000      0.6726000    
 C   0.6623000      -1.547100      -1.271400    
 C    3.632700       1.508200       1.042400    
 C    1.604300      -2.564900      -1.135700    
 C    4.575000      0.4853000       1.176900    
 C   -1.338500      0.4403000      -1.612200    
 C    1.550300       3.672300      0.7167000    
 C  -0.8058000       3.024400     -0.5846000    
 C    3.776600      -3.341400     -0.3498000    
 C    5.256500      -1.824100      0.8016000    
 C    4.986300      -3.091800      0.2931000    
 C   0.5594000       4.642400      0.5438000    
 C  -0.6198000       4.317900     -0.1076000    
 C   -3.517300     -0.3303000      -1.127900    
 C   -4.407500     -0.7798000     -2.7799999E-02
 C   -5.764900     -0.5562000     -0.1343000    
 C   -3.849400      -1.407000       1.067300    
 C   -6.600900     -0.9783000      0.8995000    
 C   -4.685400      -1.829100       2.101000    
 C   -6.061100      -1.614700       2.017000    
 H  -0.2632000      -1.842100      -1.753000    
 H    3.903600       2.474400       1.460600    
 H    1.372000      -3.551100      -1.532500    
 H    5.513200      0.7037000       1.683000    
 H   -1.221100     -0.3007000      -2.409400    
 H   -1.732100       1.292800      -2.174900    
 H    2.452800       3.985400       1.235300    
 H   -1.770200       2.846900      -1.047000    
 H    3.586400      -4.339300     -0.7394000    
 H    6.207900      -1.650900       1.300200    
 H    5.719300      -3.886400      0.3981000    
 H   0.7141000       5.648600      0.9220000    
 H   -1.396300       5.065800     -0.2368000    
 H   -6.196500     -5.8699999E-02 -0.9978000    
 H   -2.783600      -1.597400       1.150400    
 H   -7.672100     -0.8108000      0.8346000    
 H   -4.265900      -2.327500       2.970000    
 H   -6.712100      -1.943800       2.821700    


%chk=000039362-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039362

0 1
O -2.359786 -0.139897 -0.579181
O -3.957250 -0.016032 -2.273545
C 2.268346 -0.072320 -0.150591
C 0.989235 -0.422359 -0.756465
C 3.318260 -1.059646 -0.072822
C 2.490420 1.249442 0.359848
C -0.034316 0.552670 -0.868896
C 1.420345 2.230172 0.302479
C 0.156589 1.870939 -0.310793
C 3.107266 -2.398065 -0.566432
C 4.596816 -0.721706 0.501529
C 0.811612 -1.789065 -1.221779
C 3.781171 1.558038 0.925991
C 1.816104 -2.728663 -1.130418
C 4.794376 0.615801 0.993514
C -1.317363 0.243353 -1.597628
C 1.569568 3.552028 0.836456
C -0.895968 2.850888 -0.335289
C 4.151722 -3.352438 -0.481730
C 5.624990 -1.707226 0.566601
C 5.403503 -3.007814 0.079799
C 0.532143 4.485098 0.785409
C -0.717524 4.127537 0.196599
C -3.667969 -0.233527 -1.068922
C -4.640639 -0.612454 -0.003084
C -6.004816 -0.756401 -0.367921
C -4.238925 -0.827828 1.341288
C -6.960761 -1.113474 0.604641
C -5.200197 -1.184221 2.310652
C -6.560202 -1.327927 1.945544
H -0.155592 -2.092086 -1.630809
H 3.975365 2.561871 1.311931
H 1.647365 -3.753314 -1.481882
H 5.766048 0.879784 1.426948
H -1.222139 -0.592426 -2.307512
H -1.702071 1.104459 -2.168944
H 2.513017 3.846776 1.303519
H -1.869371 2.587179 -0.756701
H 3.979120 -4.367550 -0.857765
H 6.593704 -1.437426 1.002882
H 6.200442 -3.756955 0.135869
H 0.673743 5.487755 1.203027
H -1.537431 4.853277 0.170366
H -6.289487 -0.584809 -1.411356
H -3.184866 -0.713236 1.609131
H -8.013071 -1.224466 0.321726
H -4.891485 -1.349630 3.348503
H -7.303643 -1.605202 2.701413


