%chk=000155031.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155031

0 1
 O  -0.9463000       3.528200     -0.7158000    
 O    2.391200       3.223300      0.9038000    
 O    4.443900      0.7726000       1.518500    
 O   -2.904000      -1.555600     -0.2126000    
 O    7.119400      -2.961900     -0.6394000    
 O    4.962800      -3.606600     -0.9386000    
 C   0.1505000       1.506900      3.3599999E-02
 C    1.628500       1.099900     -5.1600002E-02
 C   8.9999996E-03   2.546300      -1.087300    
 C    2.320100       2.448100     -0.2882000    
 C    1.400400       3.170000      -1.275200    
 C  -0.8179000      0.3424000     -0.1327000    
 C    2.120100      0.3469000       1.176900    
 C   -2.275700      0.7622000      4.0700000E-02
 C    3.591100      1.9099999E-02   1.049500    
 C   -3.264900     -0.3910000     -5.1700000E-02
 C    3.940700      -1.284700      0.3461000    
 C   -4.729100     -1.0400000E-02  0.1042000    
 C    5.443800      -1.532200      0.2465000    
 C   -5.665700      -1.208400     -3.5300002E-02
 C   -7.125500     -0.7997000      0.1646000    
 C    5.776400      -2.803400     -0.5041000    
 C   -8.059900      -2.004600      5.8400001E-02
 C   -9.509100      -1.607600      0.2899000    
 H  -4.6500001E-02   1.982900       1.005000    
 H    1.777800      0.4760000     -0.9443000    
 H  -0.3226000       2.088900      -2.027000    
 H    3.333900       2.333200     -0.6846000    
 H    1.738600       2.959500      -2.296900    
 H    1.395300       4.255700      -1.133200    
 H  -0.6842000     -0.1302000      -1.114200    
 H  -0.5918000     -0.4329000      0.6088000    
 H    1.572100     -0.5906000       1.317600    
 H    1.974700      0.9272000       2.095500    
 H   -2.411900       1.237000       1.018800    
 H   -2.556900       1.479200     -0.7374000    
 H  -0.9799000       4.187100      -1.430100    
 H    2.822100       4.065700      0.6796000    
 H    3.503800      -1.256400     -0.6583000    
 H    3.467100      -2.104700      0.8980000    
 H   -4.967400      0.7379000     -0.6599000    
 H   -4.851900      0.4475000       1.092000    
 H    5.920000     -0.6950000     -0.2768000    
 H    5.876000      -1.604700       1.250900    
 H   -5.394900      -1.975200      0.7013000    
 H   -5.539400      -1.663500      -1.025500    
 H   -7.404200     -4.9600001E-02 -0.5856000    
 H   -7.243200     -0.3309000       1.149300    
 H   -7.965000      -2.462900     -0.9329000    
 H   -7.774500      -2.763900      0.7958000    
 H   -9.643600      -1.176800       1.287200    
 H   -10.15980      -2.483900      0.2081000    
 H   -9.836900     -0.8707000     -0.4502000    
 H    7.343200      -3.785800      -1.122400    


%chk=000155031-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000155031

0 1
O -1.168685 3.530321 -0.110555
O 3.067667 2.221598 0.832139
O 3.953758 -0.243031 -1.452628
O -3.383260 -0.862165 -1.645208
O 7.698323 -3.052241 0.614147
O 6.924059 -1.463817 2.117131
C 0.067950 1.385818 -0.174026
C 1.506490 0.991079 -0.614926
C -0.057112 2.810655 -0.759768
C 2.356478 2.289616 -0.466652
C 1.330438 3.461943 -0.508098
C -1.021523 0.395454 -0.634030
C 2.101724 -0.208074 0.140430
C -2.405617 0.674124 -0.015132
C 3.513135 -0.567008 -0.314844
C -3.526884 -0.192180 -0.585322
C 4.376171 -1.321529 0.695745
C -4.841446 -0.198798 0.202351
C 5.624032 -1.960808 0.067269
C -6.032987 -0.826695 -0.544409
C -7.306601 -0.900989 0.326335
C 6.764204 -2.100864 1.051201
C -8.510095 -1.528445 -0.413298
C -9.778854 -1.611374 0.462666
H 0.047247 1.486828 0.932396
H 1.488651 0.740551 -1.695230
H -0.254419 2.736400 -1.853124
H 3.104567 2.349632 -1.279383
H 1.586046 4.232169 -1.258948
H 1.301330 3.934414 0.492465
H -1.107627 0.417794 -1.737838
H -0.721812 -0.640469 -0.378486
H 1.467434 -1.107143 -0.016195
H 2.118817 -0.014683 1.227846
H -2.380050 0.551977 1.087642
H -2.675230 1.739610 -0.172292
H -1.220906 4.445392 -0.486236
H 3.736772 2.949462 0.868533
H 3.757375 -2.065261 1.233178
H 4.683406 -0.582383 1.465313
H -5.069771 0.839827 0.520281
H -4.651112 -0.753833 1.147721
H 5.410920 -2.945719 -0.381933
H 5.964778 -1.318113 -0.770968
H -5.749450 -1.838822 -0.890196
H -6.239112 -0.241758 -1.462429
H -7.583323 0.117419 0.672754
H -7.094396 -1.492856 1.242100
H -8.726280 -0.935758 -1.325539
H -8.232466 -2.543790 -0.762441
H -9.599118 -2.229327 1.362841
H -10.625039 -2.058753 -0.090602
H -10.091715 -0.606205 0.803856
H 8.452918 -3.089294 1.263197


