%chk=000148966.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148966

0 1
 O    1.873700     -0.6061000      0.5542000    
 O   0.5853000      0.5594000       2.111400    
 O    3.990300       2.774700     -0.4270000    
 O    3.984000      0.4907000      -2.224500    
 O    1.379900       2.994800      0.9188000    
 O    3.666800      -2.180200      -2.021300    
 O    3.106000      -2.796000      0.1006000    
 O   6.2899999E-02  -1.623500       2.896300    
 N  -0.2888000     -0.5276000       2.117800    
 C    2.917500       1.838100     -0.5374000    
 C    3.515200      0.4724000     -0.8773000    
 C    2.140100       1.794800      0.7786000    
 C    2.467600     -0.6252000     -0.7388000    
 C    1.175300      0.6093000      0.8128000    
 C    3.097900      -1.978400     -0.8077000    
 C   -1.380500     -0.5981000       1.216200    
 C   -2.111800      0.5502000      0.9269000    
 C   -3.196000      0.4977000      3.5799999E-02
 C   -1.711100      -1.811700      0.6284000    
 C   -3.537700     -0.7368000     -0.5661000    
 C   -2.785100      -1.882300     -0.2593000    
 C   -3.948500       1.643000     -0.2713000    
 C   -4.621700     -0.7896000      -1.457400    
 C   -5.022600       1.572200      -1.158900    
 C   -5.358600      0.3582000      -1.750800    
 H    2.272400       2.200600      -1.347400    
 H    4.382100      0.2747000     -0.2348000    
 H    2.830900       1.749900       1.629700    
 H    1.684600     -0.5742000      -1.505700    
 H   0.4091000      0.7738000      4.4900000E-02
 H    4.467900       2.771400      -1.274200    
 H    3.224100      0.6650000      -2.805800    
 H    2.002700       3.740200      0.8697000    
 H   -1.848300       1.495700       1.398200    
 H    4.088100      -3.063800      -2.086200    
 H   -1.144300      -2.714600      0.8395000    
 H   -3.028800      -2.841200     -0.7119000    
 H   -3.703800       2.602600      0.1793000    
 H   0.9015000      -1.893200       2.484800    
 H   -4.902200      -1.727800      -1.931800    
 H   -5.596600       2.465400      -1.388000    
 H   -6.194800      0.3038000      -2.441800    


%chk=000148966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148966

0 1
O 1.890597 -0.570945 0.560344
O 0.591894 0.592067 2.139228
O 3.711857 3.002557 -0.571270
O 4.115973 0.687546 -2.202794
O 1.151674 3.089026 0.730586
O 4.126340 -2.044651 -1.858897
O 2.757772 -3.027967 -0.255073
O 0.421126 -1.808761 2.460058
N -0.366368 -0.595564 2.376017
C 2.789994 1.867516 -0.625330
C 3.541851 0.548380 -0.865960
C 2.007155 1.907171 0.701370
C 2.513891 -0.614526 -0.762511
C 1.091496 0.678933 0.795202
C 3.103914 -2.017889 -0.886421
C -1.405103 -0.645990 1.353643
C -2.072011 0.537779 0.999593
C -3.183691 0.498799 0.102672
C -1.848237 -1.913378 0.847150
C -3.629150 -0.776295 -0.426735
C -2.935840 -1.964151 -0.024151
C -3.878638 1.693104 -0.290929
C -4.746719 -0.808284 -1.323977
C -4.963896 1.629819 -1.166763
C -5.402938 0.369564 -1.688850
H 2.072902 2.000414 -1.466507
H 4.328417 0.406479 -0.095941
H 2.721072 1.897239 1.550096
H 1.758536 -0.487756 -1.573285
H 0.284378 0.712359 0.032903
H 4.243265 3.000609 -1.408640
H 4.561347 -0.169155 -2.439974
H 1.737304 3.876733 0.585026
H -1.740045 1.495149 1.415982
H 4.481765 -2.969875 -1.951711
H -1.339841 -2.823232 1.174742
H -3.277968 -2.933030 -0.407145
H -3.543062 2.656937 0.109546
H 1.000014 -1.856290 1.629537
H -5.081488 -1.774971 -1.719355
H -5.487880 2.546580 -1.458846
H -6.256960 0.336253 -2.374133


