%chk=000100067.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100067

0 1
 O    1.063900      -1.564000      0.8698000    
 O  -0.9824000       1.666300      0.8546000    
 O    5.491500      -2.096700      -1.403200    
 O   -5.462000       2.147200      -1.325400    
 O    5.895500       1.958700       1.112000    
 O   -5.808200      -1.844400       1.298100    
 O    7.054600     -2.6000001E-02 -0.4329000    
 O   -7.002600      0.1028000     -0.2673000    
 C   0.6526000      0.4528000     -0.3520000    
 C  -0.6005000     -0.3802000     -0.3266000    
 C    1.514400     -0.2001000      0.7372000    
 C   -1.436000      0.2999000      0.7662000    
 C  -8.9800000E-02  -1.755900      3.9600000E-02
 C   0.1506000       1.837300     -8.0000004E-03
 C    2.991000     -0.1536000      0.4250000    
 C   -2.919800      0.2472000      0.4905000    
 C    3.776800      0.8910000      0.9147000    
 C   -3.694100     -0.7842000       1.024300    
 C    3.573100      -1.154700     -0.3544000    
 C   -3.519700       1.229400     -0.2994000    
 C    4.937100      -1.111400     -0.6432000    
 C   -4.890200       1.180400     -0.5545000    
 C    5.140800      0.9343000      0.6257000    
 C   -5.064600     -0.8331000      0.7689000    
 C    5.720900     -6.6900000E-02 -0.1532000    
 C   -5.662600      0.1491000     -2.0400001E-02
 C    4.620100      -3.127400      -1.864200    
 C   -5.517800       1.907500      -2.730100    
 C    6.013200       3.121900      0.2949000    
 C   -5.945700      -3.027200      0.5132000    
 H    1.150900      0.4303000      -1.327700    
 H   -1.122000     -0.3819000      -1.290400    
 H    1.344900      0.2632000       1.717700    
 H   -1.243500     -0.1393000       1.753400    
 H  -0.8250000      -2.369200      0.5682000    
 H   0.2369000      -2.300300     -0.8531000    
 H   0.8981000       2.463500      0.4869000    
 H  -0.1981000       2.359200     -0.9058000    
 H    3.329800       1.674400       1.522000    
 H   -3.233200      -1.552800       1.640000    
 H    2.921700      -1.937900     -0.7243000    
 H   -2.931100       2.035000     -0.7308000    
 H    7.276900     -0.7980000     -0.9819000    
 H   -7.381600     -0.6516000      0.2156000    
 H    5.228800      -3.825100      -2.448900    
 H    3.851900      -2.735300      -2.539500    
 H    4.194400      -3.699400      -1.032600    
 H   -6.100900       1.006500      -2.945000    
 H   -4.508500       1.809200      -3.142300    
 H   -6.007500       2.762300      -3.204500    
 H    6.476800       2.873800     -0.6650000    
 H    6.650000       3.842800      0.8149000    
 H    5.030800       3.576300      0.1316000    
 H   -4.970800      -3.503500      0.3677000    
 H   -6.400300      -2.800400     -0.4564000    
 H   -6.597200      -3.721400       1.050900    


%chk=000100067-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100067

0 1
O 1.019337 -1.808595 0.012645
O -1.125939 1.771708 0.351596
O 5.918131 -1.570430 -1.705332
O -5.571013 1.941487 -2.077650
O 5.623424 1.593970 1.958714
O -6.136992 -1.596669 1.195433
O 7.163493 0.064692 -0.062267
O -7.244436 0.000127 -0.577372
C 0.653276 0.465696 -0.684586
C -0.696661 -0.290360 -0.820068
C 1.438392 -0.420647 0.332206
C -1.563784 0.355506 0.305606
C -0.340324 -1.773377 -0.590764
C 0.265437 1.866150 -0.168196
C 2.948665 -0.313144 0.247002
C -3.061965 0.286493 0.080613
C 3.640300 0.567592 1.102211
C -3.837023 -0.651218 0.809881
C 3.660634 -1.051344 -0.732946
C -3.679133 1.106161 -0.885624
C 5.051792 -0.888138 -0.818476
C -5.068527 1.022201 -1.146532
C 5.044968 0.742732 1.006268
C -5.215958 -0.738461 0.548597
C 5.763777 -0.003175 0.040398
C -5.851629 0.092905 -0.414147
C 5.326441 -2.571824 -2.593058
C -6.690598 1.538033 -2.952660
C 6.754796 2.451821 1.548981
C -5.635330 -2.443614 2.277049
H 1.212616 0.510681 -1.634665
H -1.181844 -0.121940 -1.796304
H 1.110939 -0.166502 1.364058
H -1.317085 -0.132761 1.275248
H -1.052976 -2.274050 0.093979
H -0.294827 -2.346081 -1.534739
H 0.931032 2.214167 0.645385
H 0.263712 2.622971 -0.973284
H 3.116920 1.136646 1.877914
H -3.363510 -1.278463 1.571908
H 3.115879 -1.760045 -1.361716
H -3.097262 1.854860 -1.430143
H 7.436182 -0.572588 -0.777172
H -7.569335 -0.689780 0.062946
H 6.166530 -2.990436 -3.166517
H 4.596887 -2.105246 -3.281972
H 4.830635 -3.371089 -2.010545
H -7.610621 1.365868 -2.373400
H -6.432104 0.620710 -3.515808
H -6.814810 2.382620 -3.647617
H 7.624975 1.849065 1.246353
H 6.983636 3.053304 2.441906
H 6.453141 3.115214 0.715401
H -5.206668 -1.830719 3.092692
H -4.873384 -3.153594 1.902357
H -6.509912 -2.998693 2.646809


