%chk=000178660.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178660

0 1
 O    5.036500      -1.219000      0.1558000    
 O    3.539900       2.586600      0.2863000    
 O    5.208300       1.397000     -0.6975000    
 C   -4.726300      0.2904000     -4.3200001E-02
 C   -3.206500      5.8600001E-02 -1.2800000E-02
 C   -5.430900     -0.7705000      0.8297000    
 C   -5.240400      0.1766000      -1.494700    
 C   -5.157900       1.676800      0.4863000    
 C   -2.722100      -1.143400     -0.4640000    
 C   -2.404100       1.064300      0.4645000    
 C  -0.4947000     -0.3549000      4.1400000E-02
 C   -1.343300      -1.353700     -0.4365000    
 C   -1.025400      0.8539000      0.4921000    
 C   0.9350000     -0.5727000      7.0500001E-02
 C    1.808500      0.5057000     -7.2200000E-02
 C    1.441200      -1.861600      0.2402000    
 C    3.187300      0.2956000     -4.4399999E-02
 C    2.820000      -2.071800      0.2677000    
 C    3.693000     -0.9932000      0.1256000    
 C    4.081700       1.435100     -0.1949000    
 H   -6.513700     -0.6010000      0.8592000    
 H   -5.279000      -1.788400      0.4548000    
 H   -5.061500     -0.7411000       1.861800    
 H   -5.086100     -0.8226000      -1.916200    
 H   -6.316100      0.3814000      -1.549200    
 H   -4.731800      0.8931000      -2.150800    
 H   -6.248600       1.787900      0.4404000    
 H   -4.873500       1.822700       1.535000    
 H   -4.735800       2.493900     -0.1106000    
 H   -3.362300      -1.931400     -0.8454000    
 H   -2.761900       2.017300      0.8324000    
 H  -0.9740000      -2.298500     -0.8257000    
 H  -0.4069000       1.647400      0.9030000    
 H    1.429600       1.508200     -0.2541000    
 H   0.8010000      -2.727300      0.3856000    
 H    3.200500      -3.080300      0.4075000    
 H    5.196200      -2.170200      0.2808000    
 H    4.148300       3.348700      0.1801000    


%chk=000178660-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178660

0 1
O 5.208166 -1.261028 0.197425
O 3.499229 2.654619 -0.271835
O 5.483719 1.458868 -0.206715
C -4.856107 0.313102 -0.037744
C -3.324609 0.101451 0.014269
C -5.561743 -0.813884 0.775877
C -5.333208 0.251588 -1.520688
C -5.283636 1.681012 0.554011
C -2.756028 -1.104733 -0.479083
C -2.428538 1.068466 0.536226
C -0.471234 -0.360829 0.071870
C -1.367114 -1.332647 -0.453118
C -1.035117 0.843709 0.566277
C 0.999413 -0.598426 0.100162
C 1.919594 0.467007 -0.035915
C 1.533538 -1.906872 0.268161
C 3.326994 0.276547 -0.007648
C 2.919798 -2.128111 0.297470
C 3.830874 -1.049233 0.161968
C 4.233124 1.443306 -0.164434
H -6.659373 -0.679882 0.740416
H -5.330517 -1.816144 0.372380
H -5.243595 -0.793467 1.834325
H -5.088024 -0.718936 -1.988266
H -6.429897 0.387327 -1.575298
H -4.854682 1.046792 -2.121087
H -6.382808 1.782838 0.493685
H -4.996689 1.776088 1.617677
H -4.839289 2.525934 -0.003997
H -3.405601 -1.879185 -0.903065
H -2.811690 2.011209 0.937285
H -0.971904 -2.263598 -0.876543
H -0.382509 1.606337 1.006765
H 1.558541 1.485683 -0.196205
H 0.857008 -2.756991 0.406312
H 3.306092 -3.145995 0.439945
H 5.405412 -2.225125 0.317083
H 4.156607 3.392801 -0.379444


