%chk=000130619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130619

0 1
 O    4.250100       2.738000     -8.8299997E-02
 O   -5.478800       1.777700     -9.1000004E-03
 O    5.571700      0.8087000     -1.3900000E-02
 O   -6.406100     -0.3684000      8.1400000E-02
 C  -0.1804000      -1.880700      0.1149000    
 C  -0.3653000     -0.5166000      6.3600004E-02
 C   -1.270700      -2.937400      0.2145000    
 C   0.8592000      0.3467000      2.3399999E-02
 C   -1.692100      7.8599997E-02  4.4799998E-02
 C    1.190200      -2.450800      0.1327000    
 C   -1.760100      -3.407800      -1.150000    
 C    1.424000      0.6991000      -1.202400    
 C   -2.323500      0.4133000       1.242700    
 C    1.433900      0.7977000       1.211600    
 C   -2.333400      0.3148000      -1.171300    
 C    1.837400      -2.672800       1.348200    
 C    1.830500      -2.765000      -1.065900    
 C    2.563500       1.502600      -1.239900    
 C   -3.596000      0.9843000       1.224600    
 C    2.573400       1.601300       1.174100    
 C   -3.605900      0.8857000      -1.189500    
 C    3.138200       1.953800     -5.1700000E-02
 C   -4.237100       1.220500      8.6000003E-03
 C    3.125000      -3.208900       1.365100    
 C    3.118100      -3.301400      -1.049100    
 C    3.765300      -3.523200      0.1665000    
 C    5.453600       2.023300     -6.4000003E-02
 C   -6.523100      0.8463000      3.3199999E-02
 C    6.571200       2.990900     -0.1081000    
 C   -7.805600       1.582400      8.3999997E-03
 C    7.833800       2.554500     -9.4400004E-02
 C   -8.961100      0.9127000      3.9400000E-02
 H   -2.124400      -2.544800      0.7791000    
 H  -0.9182000      -3.801600      0.7916000    
 H   -2.567200      -4.137200      -1.026000    
 H   -2.147100      -2.579800      -1.750600    
 H  -0.9581000      -3.892600      -1.715400    
 H   0.9874000      0.3566000      -2.137400    
 H   -1.838300      0.2346000       2.199300    
 H    1.005200      0.5328000       2.175000    
 H   -1.855300      6.0800001E-02  -2.114300    
 H    1.350700      -2.434800       2.291000    
 H    1.340300      -2.597600      -2.021800    
 H    2.998000       1.773900      -2.198200    
 H   -4.082000       1.242900       2.161500    
 H    3.015800       1.949700       2.103500    
 H   -4.099500       1.067600      -2.140300    
 H    3.629000      -3.381700       2.311600    
 H    3.617000      -3.545400      -1.982300    
 H    4.768000      -3.940300      0.1796000    
 H    6.348200       4.050800     -0.1515000    
 H   -7.789900       2.665400     -3.5000000E-02
 H    8.653700       3.264500     -0.1268000    
 H    8.086000       1.500700     -5.1399998E-02
 H   -9.901900       1.452900      2.1199999E-02
 H   -9.006700     -0.1698000      8.2999997E-02


%chk=000130619-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130619

0 1
O 4.432322 2.377186 0.350392
O -5.172911 1.848382 0.101992
O 4.086491 3.857874 -1.463481
O -6.456259 0.713428 -1.531083
C -0.097717 -2.428372 0.448065
C -0.198993 -1.052219 0.317247
C -1.297142 -3.325731 0.750040
C 1.003362 -0.153229 0.288814
C -1.518855 -0.344101 0.240925
C 1.206312 -3.153394 0.290137
C -1.623579 -4.346388 -0.371257
C 1.088309 0.918108 -0.640627
C -1.774883 0.797033 1.053793
C 2.068532 -0.307835 1.220472
C -2.532492 -0.744329 -0.670639
C 1.621751 -4.149085 1.217619
C 2.033771 -2.910567 -0.842665
C 2.198254 1.789165 -0.685182
C -2.999700 1.482850 0.980048
C 3.178553 0.553235 1.203325
C -3.767015 -0.066883 -0.770127
C 3.245734 1.591896 0.246096
C -3.991996 1.048869 0.070548
C 2.832125 -4.853895 1.036558
C 3.237566 -3.620500 -1.031270
C 3.647224 -4.593689 -0.089475
C 4.779884 3.449068 -0.504037
C -6.323078 1.635316 -0.694036
C 6.091387 3.986098 -0.062378
C -7.318009 2.684532 -0.359540
C 6.677114 5.026501 -0.711250
C -8.526116 2.727118 -0.980317
H -2.187193 -2.714119 0.972565
H -1.074795 -3.898627 1.674332
H -2.467173 -4.994524 -0.071426
H -1.904356 -3.835396 -1.310267
H -0.754036 -4.991805 -0.587849
H 0.271673 1.071723 -1.354722
H -1.005662 1.141361 1.752983
H 2.019439 -1.107971 1.965171
H -2.344594 -1.592709 -1.336968
H 1.006161 -4.361271 2.099641
H 1.720296 -2.162809 -1.578722
H 2.249924 2.593599 -1.419036
H -3.203891 2.352854 1.611143
H 3.997914 0.439236 1.919209
H -4.527263 -0.387898 -1.482316
H 3.137973 -5.605867 1.773000
H 3.854474 -3.417380 -1.913919
H 4.583533 -5.144325 -0.233561
H 6.551719 3.499612 0.803105
H -7.023950 3.410870 0.404308
H 7.644595 5.427072 -0.392099
H 6.186832 5.488878 -1.575954
H -9.265170 3.497986 -0.739880
H -8.785797 1.982565 -1.741943


