%chk=000150788.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150788

0 1
 O   -5.647300      0.2773000     -0.4126000    
 O    4.381600       2.600600      0.5449000    
 O    5.511800      0.2775000       1.345600    
 C   -1.535300     -0.8972000      0.5029000    
 C   -2.389200      0.2316000     -0.1144000    
 C  -0.2251000      -1.133100     -0.2549000    
 C   0.6178000      0.1925000     -0.2194000    
 C    2.008000      1.6100001E-02 -0.9331000    
 C   -3.612800      0.1606000      0.8261000    
 C   -1.582900       1.534200     -2.4900001E-02
 C  -0.2107000       1.407600     -0.7131000    
 C   -2.524700      -2.047900      0.6515000    
 C   0.5637000      -2.319700      0.3287000    
 C   -3.841100      -1.350600       1.039700    
 C    2.686100      -1.177800     -0.2435000    
 C   -2.804200     -2.4800001E-02  -1.586800    
 C    1.936700      -2.484900     -0.3249000    
 C    2.911600       1.278800     -0.8352000    
 C    1.844200     -0.2570000      -2.449600    
 C   -4.834000      0.8545000      0.3075000    
 C    3.562700       1.445400      0.5279000    
 C    3.798700      -1.096300      0.5059000    
 C    4.403400      0.2206000      0.8193000    
 C   -5.019000       2.291800      0.7126000    
 H   -1.256500     -0.6017000       1.528600    
 H  -0.4611000      -1.389600      -1.292500    
 H   0.8269000      0.3941000      0.8430000    
 H   -3.367100      0.5967000       1.804400    
 H   -1.422900       1.807400       1.026100    
 H   -2.132400       2.364600     -0.4818000    
 H  -0.3527000       1.355400      -1.797200    
 H   0.3345000       2.336700     -0.5171000    
 H   -2.213000      -2.763500       1.419000    
 H   -2.643800      -2.599400     -0.2876000    
 H  -3.7000000E-03  -3.248500      0.1965000    
 H   0.6920000      -2.180400       1.410500    
 H   -4.667300      -1.766300      0.4538000    
 H   -4.075700      -1.542900       2.093400    
 H   -3.374500      0.8236000      -1.982500    
 H   -1.946400     -0.1558000      -2.251600    
 H   -3.428800     -0.9168000      -1.697700    
 H    1.832900      -2.803100      -1.367700    
 H    2.477000      -3.291100      0.1863000    
 H    2.373000       2.191800      -1.110000    
 H    3.716400       1.209400      -1.583700    
 H    1.476400      0.6312000      -2.975300    
 H    2.805800     -0.5262000      -2.904200    
 H    1.151900      -1.072700      -2.672800    
 H    2.819300       1.556600       1.323300    
 H    4.241000      -1.964800      0.9816000    
 H   -5.005600       2.374400       1.802200    
 H   -4.234000       2.911500      0.2767000    
 H   -5.987600       2.649600      0.3514000    
 H    5.006100       2.540500     -0.1980000    


%chk=000150788-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000150788

0 1
O -5.777586 0.312145 -0.304032
O 4.359813 2.704963 0.481173
O 5.549211 0.431223 1.365083
C -1.528612 -0.912548 0.482233
C -2.409266 0.226799 -0.133179
C -0.213755 -1.152598 -0.291273
C 0.614387 0.179088 -0.284813
C 2.024771 0.005822 -1.002282
C -3.637590 0.160094 0.869008
C -1.583473 1.534997 -0.100393
C -0.223503 1.366800 -0.833893
C -2.519605 -2.082081 0.685960
C 0.592132 -2.330606 0.307467
C -3.853632 -1.373631 1.099803
C 2.706172 -1.175167 -0.290032
C -2.887889 -0.083979 -1.576847
C 1.982795 -2.500118 -0.376758
C 2.915919 1.283983 -0.911523
C 1.853730 -0.308462 -2.520846
C -4.890124 0.892673 0.380435
C 3.555768 1.494890 0.468627
C 3.821362 -1.034796 0.502288
C 4.413735 0.269184 0.813056
C -5.024552 2.363770 0.757080
H -1.236883 -0.555367 1.498017
H -0.466410 -1.417147 -1.339019
H 0.830767 0.398941 0.786116
H -3.303290 0.646707 1.808659
H -1.391921 1.820508 0.955662
H -2.138771 2.371324 -0.569151
H -0.405021 1.229700 -1.916985
H 0.343975 2.309296 -0.727376
H -2.176404 -2.795003 1.456202
H -2.648602 -2.653129 -0.253174
H 0.019284 -3.271459 0.206921
H 0.747199 -2.157383 1.392498
H -4.707378 -1.719168 0.491725
H -4.103622 -1.569104 2.157815
H -3.432510 0.781839 -1.995993
H -2.045143 -0.302457 -2.254412
H -3.582112 -0.940334 -1.606494
H 1.830643 -2.809842 -1.428325
H 2.559341 -3.297185 0.126028
H 2.343577 2.185638 -1.187808
H 3.738750 1.199293 -1.647983
H 1.524296 0.598811 -3.058302
H 2.819530 -0.620141 -2.958457
H 1.117772 -1.103998 -2.722264
H 2.766179 1.570958 1.251109
H 4.296609 -1.912870 0.957170
H -5.232463 2.448157 1.842116
H -4.083625 2.913225 0.571071
H -5.851980 2.829608 0.199414
H 5.208105 2.468638 0.956176


