%chk=000124584.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124584

0 1
 I    11.85240       1.019300     -0.6270000    
 O   -8.218800       2.527800      0.2548000    
 O   -9.049500      0.4366000     -8.1200004E-02
 C   -2.510600      -1.069500      0.4563000    
 C   -1.319400     -0.3696000     -0.2026000    
 C   -3.836000     -0.6045000     -0.1501000    
 C   3.4400001E-02 -0.7896000      0.3813000    
 C   -5.069800      -1.210100      0.5315000    
 C    1.258900     -6.2600002E-02 -0.1874000    
 C   -6.444300     -0.7409000      5.7999999E-03
 C    2.585900     -0.5634000      0.3887000    
 C    3.804500      0.1758000     -0.1750000    
 C    5.127700     -0.3188000      0.4175000    
 C    6.356800      0.3697000     -0.1836000    
 C   -6.647200      0.7755000      0.1712000    
 C   -6.576100      -1.145500      -1.469800    
 C    7.681100     -0.1751000      0.3556000    
 C    8.874300      0.5669000     -0.2526000    
 C   -8.101200       1.183300      0.1105000    
 C    10.19680     -5.4000001E-03  0.2563000    
 H   -2.413200      -2.155200      0.3390000    
 H   -2.506300     -0.8587000       1.532400    
 H   -1.322800     -0.5775000      -1.279600    
 H   -1.430800      0.7160000     -8.9500003E-02
 H   -3.837300     -0.8602000      -1.215600    
 H   -3.887800      0.4885000     -8.4700003E-02
 H   0.1604000      -1.868500      0.2254000    
 H   1.2800000E-02 -0.6349000       1.467600    
 H   -5.014300      -2.303600      0.4488000    
 H   -5.020000     -0.9875000       1.605400    
 H    1.271500     -0.1846000      -1.277500    
 H    1.159300       1.011800      9.8000001E-03
 H   -7.211400      -1.278700      0.5778000    
 H    2.569600     -0.4503000       1.479800    
 H    2.687100      -1.636000      0.1822000    
 H    3.826500      5.1399998E-02  -1.264600    
 H    3.701200       1.250000      2.1000000E-02
 H    5.120100     -0.1622000       1.503100    
 H    5.209800      -1.400600      0.2541000    
 H    6.296000       1.446300      1.8200001E-02
 H    6.337200      0.2505000      -1.274100    
 H   -6.273900       1.085600       1.154500    
 H   -6.101000       1.327600     -0.6017000    
 H   -7.596100     -0.9755000      -1.829600    
 H   -6.357000      -2.210100      -1.605100    
 H   -5.904300     -0.5722000      -2.116500    
 H    7.702400     -7.4000001E-02   1.447300    
 H    7.754700      -1.245200      0.1274000    
 H    8.805600       1.633400     -4.4999998E-03
 H    8.830100      0.4897000      -1.346400    
 H    10.26220      -1.072400      1.5799999E-02
 H    10.25110      8.7099999E-02   1.346800    
 H   -9.153200       2.821400      0.1988000    


%chk=000124584-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124584

0 1
I 12.101773 0.926640 -0.544296
O -8.422230 2.446158 0.001801
O -9.232083 0.274704 0.081056
C -2.530504 -0.963152 0.470973
C -1.306079 -0.239477 -0.133275
C -3.880091 -0.465245 -0.095232
C 0.040764 -0.744540 0.431582
C -5.089731 -1.205501 0.523410
C 1.269427 -0.030236 -0.175280
C -6.489420 -0.801613 -0.019284
C 2.612576 -0.541901 0.392296
C 3.846728 0.162567 -0.215027
C 5.184577 -0.357044 0.358185
C 6.424065 0.337668 -0.249333
C -6.788358 0.692497 0.256820
C -6.663806 -1.140191 -1.519646
C 7.755414 -0.190728 0.334235
C 8.994815 0.506952 -0.286561
C -8.253341 1.053207 0.101370
C 10.289263 -0.038846 0.322325
H -2.438635 -2.054319 0.286785
H -2.525242 -0.834143 1.573919
H -1.312415 -0.368073 -1.236057
H -1.395408 0.851553 0.052337
H -3.879063 -0.598209 -1.195718
H -3.965233 0.625242 0.090067
H 0.126139 -1.836647 0.250124
H 0.047990 -0.612246 1.533977
H -4.958656 -2.294971 0.357705
H -5.072964 -1.055702 1.623973
H 1.262629 -0.162738 -1.277568
H 1.186469 1.061873 0.006614
H -7.243120 -1.391165 0.541303
H 2.619279 -0.406124 1.494258
H 2.691164 -1.635071 0.214263
H 3.841365 0.026121 -1.316749
H 3.770657 1.255679 -0.036762
H 5.188890 -0.217007 1.459531
H 5.255504 -1.451223 0.183850
H 6.355808 1.431518 -0.075429
H 6.423181 0.195093 -1.349803
H -6.503542 0.956010 1.296832
H -6.197674 1.358727 -0.397896
H -7.703938 -0.959242 -1.844014
H -6.433438 -2.205122 -1.707340
H -5.994000 -0.531821 -2.155842
H 7.756666 -0.042224 1.433934
H 7.820181 -1.285277 0.163356
H 8.930934 1.598777 -0.117355
H 8.999194 0.350848 -1.382119
H 10.436107 -1.111813 0.122532
H 10.370557 0.160643 1.402213
H -9.395045 2.650432 -0.065038


