%chk=000003730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003730

0 1
 I   -2.954500      -1.943800     -0.5144000    
 I    2.848800     -0.9844000       1.115500    
 I  -0.7347000       3.741600     -0.3363000    
 O    2.463700      -4.156500      0.2374000    
 O    3.754400      -4.409400      -2.214300    
 O  -7.9499997E-02  -4.373800       1.822300    
 O    5.439800       1.464900      -1.012300    
 O   -6.146500      0.2013000       1.043000    
 O    2.061400       2.544700       1.704200    
 O   -3.067300       1.423600      -1.954200    
 O    7.501300       2.596400      0.4744000    
 O   -8.378600      0.3833000     -0.6074000    
 N   8.0799997E-02  -2.481100      0.4233000    
 N    2.730300       2.342600     -0.5068000    
 N   -3.740000       1.594100      0.2592000    
 C   0.4464000      -3.295800     -0.7726000    
 C  -9.9900000E-02  -1.100600      0.2541000    
 C    1.954200      -3.492100     -0.9194000    
 C   -1.338500     -0.6039000     -0.1519000    
 C   0.9590000     -0.2244000      0.4920000    
 C   -1.518200      0.7691000     -0.3200000    
 C   0.7792000       1.148600      0.3239000    
 C  -0.4593000       1.645300     -8.2000002E-02
 C    2.335300      -4.305800      -2.152000    
 C  -0.1570000      -3.152400       1.667800    
 C    1.890700       2.068000      0.5734000    
 C   -2.837000       1.297400     -0.7544000    
 C    3.882400       3.210300     -0.4133000    
 C   -5.064700       2.090000     -2.4999999E-03
 C    5.159100       2.463700     -3.1099999E-02
 C   -6.097100      0.9747000     -0.1565000    
 C  -0.4884000      -2.307100       2.876300    
 C    6.374100       3.377800      9.0300001E-02
 C   -7.499800       1.493700     -0.4555000    
 H   4.1999999E-02  -2.816800      -1.671700    
 H  -4.0399998E-02  -4.272700     -0.6669000    
 H    2.466900      -2.542600      -1.053600    
 H    1.931100      -5.321400      -2.087600    
 H    1.975600      -3.828600      -3.068900    
 H    3.672700       4.003300      0.3126000    
 H    3.995900       3.669200      -1.401800    
 H   -5.324300       2.726700      0.8506000    
 H   -5.042800       2.714600     -0.9022000    
 H    5.018600       1.933000      0.9180000    
 H   -5.796500      0.2863000     -0.9552000    
 H    2.535700       1.906300      -1.403600    
 H   -3.465100       1.446700       1.226300    
 H  -0.7664000      -2.959100       3.710300    
 H   0.3778000      -1.715800       3.177800    
 H   -1.335200      -1.648300       2.671700    
 H    2.355300      -3.552400      0.9909000    
 H    6.210300       4.153800      0.8442000    
 H    6.607000       3.846200     -0.8715000    
 H   -7.874700       2.103100      0.3733000    
 H   -7.514300       2.082700      -1.377600    
 H    3.966700      -4.932600      -3.006000    
 H    4.661800      0.8838000      -1.066300    
 H   -5.248600     -0.1326000       1.210700    
 H    8.258000       3.203300      0.5428000    
 H   -9.262000      0.7436000     -0.7958000    


%chk=000003730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003730

0 1
I -2.667239 -2.176488 -0.911300
I 2.904600 -1.068538 1.458163
I -0.701894 3.630106 -0.252347
O 1.434356 -5.775754 -0.334059
O 3.784917 -5.714397 -1.592472
O -0.092350 -4.680900 1.535724
O 4.706506 2.913912 -1.757503
O -5.799222 1.387067 1.407904
O 1.898452 2.395575 2.260037
O -2.692755 1.231207 -2.408862
O 7.278576 3.587458 -1.149683
O -8.380715 1.030935 0.607819
N 0.287945 -2.696918 0.377970
N 2.775819 2.497950 0.098230
N -3.680959 1.417867 -0.301683
C 0.857378 -3.390951 -0.825433
C 0.059011 -1.280081 0.259920
C 1.971844 -4.430123 -0.545344
C -1.153013 -0.776952 -0.293019
C 1.053033 -0.339488 0.648590
C -1.383775 0.611152 -0.452429
C 0.853728 1.057151 0.515266
C -0.370277 1.510626 -0.036422
C 2.887250 -4.580732 -1.777279
C -0.177879 -3.411022 1.482937
C 1.889321 2.045157 1.040655
C -2.643545 1.116459 -1.146650
C 3.836788 3.463700 0.404286
C -4.977771 1.908242 -0.780725
C 5.109913 3.057309 -0.347526
C -6.097461 1.186535 -0.021121
C -0.781015 -2.617471 2.630789
C 6.235061 4.090657 -0.235922
C -7.492614 1.733864 -0.338259
H 1.256798 -2.588148 -1.471646
H 0.044282 -3.902765 -1.376165
H 2.576251 -4.112114 0.329358
H 2.259252 -4.715989 -2.686588
H 3.523408 -3.687543 -1.904934
H 3.989362 3.472097 1.497124
H 3.522915 4.478155 0.084460
H -5.053776 3.000119 -0.604485
H -5.033064 1.721899 -1.866929
H 5.476757 2.079905 0.031154
H -6.071581 0.101007 -0.253920
H 2.721943 2.189888 -0.877748
H -3.590409 1.310991 0.713277
H -0.967006 -3.314186 3.460624
H -0.106126 -1.812985 2.971736
H -1.739575 -2.154249 2.334520
H 0.789415 -5.692524 0.434818
H 6.606440 4.149857 0.807412
H 5.871578 5.086857 -0.563139
H -7.521135 2.829681 -0.164894
H -7.767330 1.512330 -1.389618
H 3.221638 -6.425138 -1.178096
H 5.540052 2.825621 -2.289987
H -6.601490 1.092943 1.914114
H 8.029199 4.227461 -1.206654
H -9.304809 1.373421 0.536651


