%chk=000072978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072978

0 1
 O   -3.173300      -1.688500     -4.3900002E-02
 O    1.612800      -1.409500     -0.1188000    
 O   -3.718900       1.833300      -1.115100    
 O   -1.014400       2.624000      0.1457000    
 O  -1.8700000E-02   4.678900      0.2119000    
 C   -4.569600      0.2372000      0.5147000    
 C   -3.437200       1.209000      0.1384000    
 C   -4.415400      -1.030900     -0.3417000    
 C   -2.110000      0.4936000      6.8200000E-02
 C   -2.049800     -0.9001000     -2.8400000E-02
 C  -0.8055000      -1.557200     -7.2400004E-02
 C  -0.9028000       1.215100      7.5700000E-02
 C   0.3848000     -0.8055000     -4.4900000E-02
 C   0.3538000      0.6033000      1.6100001E-02
 C   -5.941800      0.8984000      0.3740000    
 C    1.736600      -2.823100      0.1211000    
 C   -5.509300      -2.064600     -8.6000003E-02
 C  -0.7250000      -3.013500     -0.1727000    
 C    1.556300       1.471200      2.6300000E-02
 C   0.4667000      -3.603900     -7.2300002E-02
 C    2.793600      -3.320100     -0.8726000    
 C    2.251500      -3.006600       1.553400    
 C    1.398700       2.803800      9.1300003E-02
 C    2.966300       1.030200     -3.2099999E-02
 C   8.6000003E-02   3.459100      0.1550000    
 C    3.593700      0.8821000      -1.265700    
 C    3.657600      0.7662000       1.146600    
 C    4.924100      0.4665000      -1.321000    
 C    4.988000      0.3508000       1.091500    
 C    5.621200      0.2009000     -0.1424000    
 H   -4.427700     -4.2800002E-02   1.568800    
 H   -3.397000       1.997500      0.9001000    
 H   -4.423500     -0.7862000      -1.412300    
 H   -5.960900       1.864200      0.8903000    
 H   -6.204500       1.066900     -0.6756000    
 H   -6.724400      0.2778000      0.8218000    
 H   -5.557600      -2.327900      0.9764000    
 H   -6.491700      -1.707100     -0.4066000    
 H   -5.292100      -2.991400     -0.6289000    
 H   -1.622300      -3.606400     -0.3028000    
 H   0.5233000      -4.688600     -0.1115000    
 H   -2.932600       2.334600      -1.390200    
 H    3.731500      -2.764500     -0.7556000    
 H    2.466100      -3.156000      -1.906400    
 H    3.009000      -4.386700     -0.7446000    
 H    3.187300      -2.456800       1.705500    
 H    2.429600      -4.060900       1.791900    
 H    1.537500      -2.605500       2.282600    
 H    2.251400       3.478900      0.1001000    
 H    3.062500       1.083500      -2.192600    
 H    3.176400      0.8759000       2.115300    
 H    5.416800      0.3486000      -2.281600    
 H    5.530500      0.1424000       2.009000    
 H    6.656800     -0.1236000     -0.1855000    


%chk=000072978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072978

0 1
O -3.147900 -1.696993 -0.334860
O 1.665961 -1.505539 -0.053874
O -3.752159 2.005483 -0.893676
O -1.020936 2.553621 0.397582
O -0.132548 4.632973 0.859166
C -4.560623 0.172685 0.501593
C -3.411690 1.184015 0.291748
C -4.442228 -0.945439 -0.556335
C -2.085063 0.467212 0.109300
C -2.011427 -0.921981 -0.138428
C -0.761548 -1.607231 -0.174746
C -0.868423 1.176132 0.192085
C 0.435924 -0.859240 -0.025514
C 0.428160 0.574868 0.083634
C -5.935735 0.870605 0.482305
C 1.722385 -2.987917 0.303050
C -5.522702 -2.021443 -0.513139
C -0.663858 -3.040478 -0.456101
C 1.594697 1.450066 0.163753
C 0.516043 -3.699618 -0.287987
C 3.049720 -3.457569 -0.310026
C 1.732081 -3.077437 1.846042
C 1.415396 2.801343 0.446878
C 2.999184 1.007692 -0.106081
C 0.127186 3.439394 0.610134
C 3.347449 0.406706 -1.344269
C 4.026398 1.294532 0.830158
C 4.691524 0.097889 -1.635903
C 5.370950 0.966283 0.546288
C 5.709131 0.370378 -0.690002
H -4.407530 -0.298209 1.495639
H -3.343242 1.848506 1.176306
H -4.369900 -0.485110 -1.562733
H -5.946918 1.707365 1.203946
H -6.146325 1.294740 -0.513493
H -6.743954 0.171893 0.760316
H -5.629761 -2.434277 0.505830
H -6.493430 -1.604134 -0.830157
H -5.263078 -2.846803 -1.198103
H -1.559518 -3.548035 -0.824582
H 0.626842 -4.761326 -0.534944
H -3.095751 2.747998 -0.933317
H 3.882260 -2.837362 0.062883
H 3.020322 -3.380067 -1.409811
H 3.239232 -4.510574 -0.033814
H 2.590632 -2.516590 2.256176
H 1.813681 -4.133383 2.162072
H 0.798180 -2.666873 2.267558
H 2.277099 3.471589 0.494763
H 2.564051 0.187591 -2.077049
H 3.765730 1.755589 1.789844
H 4.947052 -0.353322 -2.601130
H 6.150674 1.180740 1.285558
H 6.752703 0.125063 -0.917037


