%chk=000099743.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099743

0 1
 O   -2.915800     -0.2989000      -2.303100    
 C  -0.7559000       1.780700      0.3160000    
 C   0.3226000      0.8192000     -0.2030000    
 C   -2.165400       1.574300     -0.2802000    
 C    1.741700       1.062200      0.3216000    
 C    2.826700      0.1387000     -0.2402000    
 C    4.212700      0.3964000      0.3546000    
 C   -2.757000      0.2109000      3.3399999E-02
 C    5.256600     -0.5477000     -0.2459000    
 C   -3.108400       2.686100      0.1982000    
 C    6.648400     -0.2720000      0.3225000    
 C   -3.096900     -0.6444000     -0.9975000    
 C   -2.939400     -0.1359000       1.359100    
 C    7.682300      -1.229700     -0.2476000    
 C   -3.639000      -1.892800     -0.6919000    
 C   -3.481700      -1.384400       1.664700    
 C   -3.831500      -2.262700      0.6393000    
 H  -0.7862000       1.716200       1.410900    
 H  -0.4305000       2.804200      8.6099997E-02
 H   3.9900001E-02 -0.2109000      4.5299999E-02
 H   0.3434000      0.8786000      -1.298500    
 H   -2.068200       1.700000      -1.365600    
 H    2.021200       2.101200      0.1058000    
 H    1.727300      0.9673000       1.414700    
 H    2.539800     -0.9028000     -4.9899999E-02
 H    2.868100      0.2613000      -1.329500    
 H    4.503200       1.436800      0.1649000    
 H    4.176200      0.2634000       1.442400    
 H    5.276800     -0.4299000      -1.336200    
 H    4.972800      -1.586700     -3.8400002E-02
 H   -2.738200       3.666600     -0.1214000    
 H   -3.202100       2.710000       1.289300    
 H   -4.112300       2.557400     -0.2221000    
 H    6.946300      0.7580000      9.4899997E-02
 H    6.631400     -0.3713000       1.414200    
 H   -2.675400      0.5323000       2.172700    
 H    7.746800      -1.134600      -1.336300    
 H    8.670200      -1.014300      0.1713000    
 H    7.430500      -2.267600     -7.4000000E-03
 H   -3.916100      -2.587200      -1.480600    
 H   -3.631900      -1.672500       2.701000    
 H   -4.253800      -3.234600      0.8773000    
 H   -3.214000      -1.031100      -2.869500    


%chk=000099743-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099743

0 1
O -2.888807 -0.264390 -2.313446
C -0.758126 1.832658 0.312714
C 0.303161 0.861497 -0.249128
C -2.181909 1.626494 -0.281627
C 1.715973 1.113381 0.323244
C 2.783741 0.148628 -0.239923
C 4.198997 0.402125 0.326364
C -2.744685 0.241242 0.046899
C 5.267063 -0.562355 -0.236610
C -3.146717 2.743204 0.199127
C 6.683045 -0.306105 0.328020
C -3.093670 -0.679534 -0.977646
C -2.949695 -0.175687 1.385365
C 7.743201 -1.275561 -0.238032
C -3.624822 -1.957613 -0.679210
C -3.476777 -1.447218 1.704852
C -3.816289 -2.342323 0.665294
H -0.799096 1.736225 1.418027
H -0.444385 2.876664 0.103834
H -0.001552 -0.181899 -0.030877
H 0.331442 0.952811 -1.354809
H -2.099138 1.699563 -1.381550
H 2.019381 2.160030 0.108618
H 1.685586 1.020024 1.429385
H 2.482717 -0.897333 -0.020927
H 2.810337 0.237977 -1.346290
H 4.499170 1.448593 0.107160
H 4.172027 0.313089 1.432862
H 5.294049 -0.475323 -1.343260
H 4.969628 -1.609124 -0.015649
H -2.761122 3.738494 -0.091267
H -3.257991 2.732526 1.299851
H -4.151518 2.619380 -0.243076
H 6.979756 0.739389 0.105079
H 6.654425 -0.391109 1.433698
H -2.688475 0.514660 2.196613
H 7.810015 -1.189481 -1.339241
H 8.746550 -1.069768 0.178531
H 7.486910 -2.325419 -0.000143
H -3.886395 -2.648819 -1.492094
H -3.621364 -1.736378 2.751171
H -4.226619 -3.331804 0.894668
H -3.152821 -0.981612 -2.941166


