%chk=000111371.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111371

0 1
 O  -1.3800000E-02  -1.890400      7.6000001E-03
 O    3.842200     -3.8899999E-02  0.4409000    
 O    2.711700      -1.487400     -0.9592000    
 C    1.515700     -0.1177000      0.6103000    
 C  -0.7097000      0.3585000     -0.3455000    
 C    1.334900       1.378600      0.3706000    
 C  -6.0699999E-02   1.517100     -0.1709000    
 C   -2.063900      4.4000000E-02 -0.8568000    
 C   0.2328000     -0.6949000      8.2800001E-02
 C   -3.140300     -2.4300000E-02  0.2355000    
 C   -4.541700     -0.2874000     -0.3246000    
 C  -0.5695000       2.889200     -0.4622000    
 C    2.733700     -0.6429000     -7.4100003E-02
 C   -5.586900     -0.3180000      0.7912000    
 C   -6.986200     -0.5370000      0.2380000    
 C    5.088400     -0.4525000     -0.1285000    
 C    6.213400      0.3041000      0.5449000    
 H    1.573700     -0.3466000       1.680700    
 H    2.059400       1.788200     -0.3427000    
 H    1.437100       1.929500       1.312400    
 H   -2.356900      0.7987000      -1.597200    
 H   -2.041700     -0.9053000      -1.406600    
 H   -2.881600     -0.8140000      0.9524000    
 H   -3.148300      0.9199000      0.7953000    
 H   -4.548200      -1.241600     -0.8650000    
 H   -4.798300      0.4964000      -1.047700    
 H  -0.5437000       3.502700      0.4441000    
 H   -1.601000       2.881000     -0.8261000    
 H   5.1500000E-02   3.370400      -1.224300    
 H   -5.349700      -1.118700       1.501300    
 H   -5.566100      0.6262000       1.347800    
 H   -7.716900     -0.5573000       1.052600    
 H   -7.050600      -1.488200     -0.3000000    
 H   -7.266500      0.2670000     -0.4499000    
 H    5.221300      -1.529000      2.6600000E-02
 H    5.088300     -0.2368000      -1.202700    
 H    7.183100      1.1800000E-02  0.1325000    
 H    6.084100       1.383500      0.4140000    
 H    6.215300      0.1127000       1.623100    


%chk=000111371-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111371

0 1
O 0.455858 -1.078269 0.194843
O 3.615542 -0.214139 0.616445
O 3.366388 0.945395 -1.392122
C 1.652748 1.130543 0.379023
C -0.634872 0.988407 -0.546966
C 1.188738 2.511497 -0.137233
C -0.240094 2.303769 -0.625240
C -1.945227 0.353212 -0.939605
C 0.462914 0.167344 0.019123
C -2.901301 0.146931 0.269471
C -4.205276 -0.578385 -0.127631
C -1.038429 3.467026 -1.141199
C 2.950563 0.647784 -0.246274
C -5.176283 -0.775930 1.059046
C -6.470510 -1.517365 0.659956
C 4.842463 -0.877688 0.072874
C 5.336897 -1.832790 1.153725
H 1.764639 1.100111 1.477152
H 1.831859 2.846521 -0.974344
H 1.238845 3.292331 0.645315
H -2.457473 0.956022 -1.714007
H -1.731917 -0.639055 -1.382720
H -2.373474 -0.440286 1.046190
H -3.142304 1.131417 0.720529
H -3.952833 -1.567649 -0.562668
H -4.719214 -0.007082 -0.929594
H -1.160082 4.237269 -0.354033
H -2.041543 3.170086 -1.487961
H -0.511178 3.961453 -1.980694
H -4.658338 -1.339245 1.861635
H -5.432989 0.213656 1.489604
H -7.147511 -1.645070 1.524614
H -6.242252 -2.522453 0.257816
H -7.021733 -0.961383 -0.122082
H 4.565081 -1.399521 -0.860400
H 5.579842 -0.092470 -0.174566
H 6.241242 -2.361423 0.801002
H 5.591206 -1.287080 2.078518
H 4.564407 -2.582894 1.393058


