%chk=000114855.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114855

0 1
 O   -3.784400      -1.214300     -0.2501000    
 O   -5.000700      0.6427000      0.6229000    
 O   -2.676600       1.704000      -1.688000    
 O   8.5400000E-02   1.407600     -0.1958000    
 O   0.4067000      -3.408900      0.4479000    
 O    2.488000      -1.838600      0.4598000    
 O    4.591600     -0.2875000      0.4816000    
 C   -2.861900       1.047700     -0.4507000    
 C   -4.139100      0.1781000     -0.4458000    
 C   -1.822600      1.8300001E-02 -0.2114000    
 C   -2.421300      -1.229700     -0.1149000    
 C  -0.4468000      0.1500000     -8.9199997E-02
 C   -3.128700       1.987100      0.6599000    
 C   0.3098000      -1.003200      0.1331000    
 C   -1.687300      -2.381400      0.1042000    
 C   -4.314900       1.698100       1.181300    
 C  -0.3024000      -2.264900      0.2299000    
 C    1.769400     -0.8698000      0.2644000    
 C    2.320900      0.4892000      0.1501000    
 C    1.445000       1.551100     -7.3600002E-02
 C    3.695200      0.7148000      0.2631000    
 C    1.946600       2.849300     -0.1854000    
 C    4.190500       2.014100      0.1507000    
 C    3.318200       3.079500     -7.3200002E-02
 C   0.8723000      -4.110600     -0.7025000    
 C    5.147100     -0.9224000     -0.6684000    
 H   -4.700300      0.2536000      -1.385800    
 H   -2.477700       2.782500      0.9891000    
 H   -2.177500      -3.346800      0.1783000    
 H   -4.818100       2.182000       1.999300    
 H   -2.204900       1.111300      -2.297400    
 H    1.275600       3.686200     -0.3598000    
 H    5.256800       2.206200      0.2373000    
 H    3.707200       4.089900     -0.1601000    
 H   3.5900000E-02  -4.620800      -1.190400    
 H    1.597100      -4.861500     -0.3763000    
 H    1.360600      -3.437600      -1.414800    
 H    4.370700      -1.203500      -1.387200    
 H    5.667400      -1.827200     -0.3426000    
 H    5.870900     -0.2561000      -1.147900    


%chk=000114855-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114855

0 1
O -3.888756 -1.176839 -0.315059
O -5.132071 0.713179 0.536583
O -2.791862 1.879108 -1.678563
O 0.058314 1.370282 -0.263977
O 0.242100 -3.612004 0.094217
O 2.439573 -1.745206 0.989612
O 4.807746 -0.124126 0.067825
C -2.917714 1.092792 -0.441743
C -4.246402 0.253101 -0.531855
C -1.871162 0.011068 -0.285496
C -2.489867 -1.249060 -0.195886
C -0.481841 0.076699 -0.199386
C -3.150781 1.923427 0.812148
C 0.335017 -1.085068 -0.006980
C -1.768305 -2.439340 -0.063847
C -4.388708 1.657780 1.297531
C -0.354202 -2.359129 0.012710
C 1.763580 -0.876937 0.340688
C 2.342517 0.455046 -0.011245
C 1.454535 1.558270 -0.208562
C 3.748429 0.774439 -0.002942
C 1.870274 2.895980 -0.306399
C 4.177217 2.123748 -0.071669
C 3.249434 3.172398 -0.210720
C 1.529044 -3.909562 -0.557791
C 4.758142 -1.448187 -0.574295
H -4.781929 0.327447 -1.487663
H -2.409051 2.590875 1.247292
H -2.248977 -3.418669 -0.052960
H -4.928333 2.045858 2.160334
H -1.918057 2.348139 -1.651201
H 1.125000 3.684563 -0.437193
H 5.253758 2.312154 -0.044038
H 3.603768 4.206260 -0.271616
H 1.675950 -3.272534 -1.450482
H 1.452942 -4.967094 -0.856316
H 2.350285 -3.750859 0.156347
H 4.386891 -2.195054 0.142627
H 5.799233 -1.655309 -0.868655
H 4.107971 -1.429135 -1.469776


