%chk=000093752.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093752

0 1
 O    2.989000       1.487900     -4.1099999E-02
 C   -2.085800      0.2864000      2.6500000E-02
 C   -3.354100     -0.5694000     -1.4900000E-02
 C  -0.8269000     -0.5826000     -7.1000000E-03
 C   -4.611200      0.3008000      5.0700001E-02
 C   0.4410000      0.2771000      1.1000000E-03
 C   -5.913900     -0.5060000      4.3299999E-02
 C    1.715300     -0.5634000     -5.9900001E-02
 C   -7.169800      0.3696000      3.0900000E-02
 C    4.288100     -0.5447000     -4.6799999E-02
 C    2.996500      0.2582000     -5.9900001E-02
 C    5.530800      0.3419000     -1.4100000E-02
 C   -8.468800     -0.4368000     -4.8700001E-02
 C    6.809700     -0.4946000      3.7799999E-02
 C    8.054800      0.3920000      3.7000000E-02
 C   -9.723600      0.4208000      9.6000005E-03
 C    9.328900     -0.4372000      5.5599999E-02
 H   -2.081400      0.9752000     -0.8270000    
 H   -2.083200      0.8986000      0.9365000    
 H   -3.368300      -1.166600     -0.9345000    
 H   -3.352700      -1.271400      0.8276000    
 H  -0.8193000      -1.256600      0.8579000    
 H  -0.8368000      -1.209600     -0.9069000    
 H   -4.612800      0.9916000     -0.8018000    
 H   -4.580900      0.9177000      0.9573000    
 H   0.4569000      0.8989000      0.9051000    
 H   0.4209000      0.9674000     -0.8516000    
 H   -5.924500      -1.157100     -0.8398000    
 H   -5.937700      -1.162900      0.9214000    
 H    1.750100      -1.235600      0.8049000    
 H    1.712700      -1.172700     -0.9708000    
 H   -7.124600       1.057600     -0.8223000    
 H   -7.182500      0.9888000      0.9364000    
 H    4.271000      -1.192600      0.8366000    
 H    4.301900      -1.175300     -0.9426000    
 H    5.490300       1.005800      0.8585000    
 H    5.544900      0.9872000     -0.9013000    
 H   -8.498400      -1.157900      0.7770000    
 H   -8.478300      -1.018300     -0.9782000    
 H    6.840600      -1.170100     -0.8259000    
 H    6.804300      -1.121300      0.9379000    
 H    8.056700       1.031400     -0.8534000    
 H    8.041500       1.053100      0.9113000    
 H   -9.767300      0.9851000      0.9465000    
 H   -10.61740     -0.2076000     -5.2299999E-02
 H   -9.748000       1.132500     -0.8216000    
 H    9.374000      -1.066900      0.9499000    
 H    10.20670      0.2166000      5.6000002E-02
 H    9.388500      -1.085100     -0.8247000    


%chk=000093752-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093752

0 1
O 3.038046 1.553306 0.055198
C -2.118904 0.331932 0.015499
C -3.411176 -0.514989 -0.005620
C -0.828350 -0.517925 -0.005114
C -4.700741 0.336433 0.012065
C 0.457240 0.337866 0.019213
C -5.994329 -0.508967 -0.008910
C 1.738065 -0.516202 -0.005601
C -7.283515 0.343097 0.008736
C 4.343443 -0.512947 0.001219
C 3.039637 0.293523 0.020187
C 5.621905 0.344995 0.022363
C -8.577698 -0.502219 -0.014843
C 6.909841 -0.507421 0.002195
C 8.198560 0.346341 0.024951
C -9.859928 0.358004 0.004158
C 9.486016 -0.505534 0.003611
H -2.117160 1.020015 -0.855465
H -2.117578 0.976709 0.919021
H -3.411682 -1.161108 -0.908656
H -3.414106 -1.201663 0.866944
H -0.832599 -1.207751 0.865373
H -0.830302 -1.161047 -0.910683
H -4.697991 1.022961 -0.860396
H -4.700345 0.982915 0.914631
H 0.465623 0.980878 0.920234
H 0.465519 1.031337 -0.843519
H -5.995021 -1.155148 -0.911890
H -5.997435 -1.195641 0.863625
H 1.752970 -1.219771 0.854354
H 1.754608 -1.164996 -0.907692
H -7.281141 1.030913 -0.862833
H -7.285222 0.988291 0.912338
H 4.329270 -1.210210 0.866351
H 4.329911 -1.168425 -0.896011
H 5.611426 0.992043 0.920481
H 5.611992 1.034626 -0.843471
H -8.578804 -1.189962 0.855519
H -8.575150 -1.145626 -0.918502
H 6.917022 -1.151803 -0.902487
H 6.915337 -1.196099 0.873620
H 8.193381 1.034843 -0.844362
H 8.192203 0.988948 0.928756
H -9.901719 0.985826 0.914337
H -10.770645 -0.268611 -0.016451
H -9.895056 1.034871 -0.870455
H 9.528064 -1.182278 0.878084
H 10.391788 0.127965 0.023108
H 9.531631 -1.132396 -0.907114


