%chk=000177146.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177146

0 1
 O    4.937800       1.033000     -2.1800000E-02
 O   -4.436700       1.851100     -0.2280000    
 O   -1.307300      -3.535200      0.2380000    
 O   0.6667000      -3.189700       1.302600    
 C  -1.0800000E-02  -1.639400     -0.4695000    
 C    1.297000     -0.9329000     -0.3511000    
 C   -1.215100     -0.6900000     -0.4037000    
 C    2.208000     -0.9708000      -1.406500    
 C   -1.676400     -0.1376000      -1.573300    
 C    1.609200     -0.2343000      0.8152000    
 C   -1.779200     -0.4338000      0.8222000    
 C  -0.1605000      -2.842700      0.4713000    
 C    3.431500     -0.3101000      -1.295700    
 C   -2.770600      0.7254000      -1.513500    
 C    2.832600      0.4266000      0.9261000    
 C   -2.873400      0.4292000      0.8821000    
 C    3.743800      0.3888000     -0.1295000    
 C   -3.369300       1.008800     -0.2858000    
 C    4.973800       2.201100      0.7968000    
 C   -5.386500       1.625200      0.8126000    
 C    6.035600       3.141500      0.2675000    
 C   -6.750300       2.085800      0.3439000    
 H  -4.1299999E-02  -2.113900      -1.463700    
 H    1.981900      -1.509800      -2.322600    
 H   -1.214400     -0.3517000      -2.531800    
 H   0.9284000     -0.2050000       1.660200    
 H   -1.404400     -0.8671000       1.743700    
 H    4.137400     -0.3429000      -2.121200    
 H   -3.152200       1.174400      -2.426600    
 H    3.049400      0.9328000       1.862100    
 H   -3.292100      0.6453000       1.860600    
 H    4.018700       2.741000      0.7801000    
 H    5.214300       1.912200       1.825800    
 H   -5.468400      0.5609000       1.066700    
 H   -5.088800       2.192900       1.701000    
 H   -1.386500      -4.317900      0.8240000    
 H    6.098300       4.045800      0.8794000    
 H    7.015100       2.651900      0.2602000    
 H    5.816100       3.428700     -0.7662000    
 H   -7.503200       1.936700       1.123000    
 H   -6.727100       3.146800      7.4000001E-02
 H   -7.055900       1.536400     -0.5528000    


%chk=000177146-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177146

0 1
O 4.833767 1.335566 -0.280803
O -4.861658 1.470991 -0.383004
O 0.271886 -4.100896 -0.146957
O -0.027752 -2.790159 1.739753
C -0.058239 -1.742749 -0.531181
C 1.223089 -0.888886 -0.431294
C -1.352708 -0.926694 -0.406965
C 2.275575 -1.087773 -1.362203
C -1.884497 -0.336696 -1.585968
C 1.393480 0.079305 0.584072
C -2.022114 -0.694343 0.817173
C 0.040848 -2.873756 0.493275
C 3.461695 -0.334961 -1.288846
C -3.044838 0.454425 -1.548076
C 2.578314 0.841723 0.674758
C -3.193453 0.096666 0.871920
C 3.617853 0.635465 -0.268007
C -3.708221 0.674093 -0.314208
C 5.050483 2.357815 0.762173
C -5.598867 1.723419 0.870625
C 6.431886 2.956854 0.512402
C -6.800350 2.592358 0.508348
H -0.052261 -2.231234 -1.520626
H 2.166445 -1.840713 -2.152239
H -1.378714 -0.497160 -2.545922
H 0.592222 0.247442 1.311086
H -1.635911 -1.142600 1.738314
H 4.275412 -0.478538 -2.006183
H -3.457686 0.906792 -2.454935
H 2.676036 1.584154 1.472265
H -3.687303 0.249143 1.836148
H 4.257162 3.130411 0.691738
H 4.992574 1.881934 1.762901
H -5.918925 0.756809 1.311768
H -4.932762 2.238105 1.593767
H 0.373666 -4.813652 0.542062
H 6.652802 3.731251 1.269380
H 7.210178 2.177032 0.571284
H 6.480189 3.420177 -0.487741
H -7.393495 2.817639 1.413326
H -6.470264 3.544657 0.059424
H -7.450347 2.074087 -0.217005


