%chk=000142979.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142979

0 1
 O    5.494300      -2.027800      0.6024000    
 O   -5.496400      -2.029300     -0.5981000    
 N    5.653700      0.2379000      5.9000002E-03
 N   -5.656000      0.2374000     -4.9000001E-03
 C    5.722100       2.739300     -2.1500001E-02
 C   -5.725600       2.738600      1.8800000E-02
 C    4.975900       1.474900     -0.4393000    
 C   -4.978000       1.475300      0.4374000    
 C    7.181600       2.684800     -0.4608000    
 C   -7.184300       2.684200      0.4607000    
 C    7.781700       1.347400     -0.1596000    
 C   -7.784200       1.346000      0.1625000    
 C    7.042000      0.2556000      7.6800004E-02
 C   -7.044400      0.2542000     -7.3500000E-02
 C    4.972300     -0.9581000      0.2882000    
 C   -4.974400     -0.9588000     -0.2866000    
 C    3.503300     -0.9585000      0.2022000    
 C   -3.505300     -0.9584000     -0.2029000    
 C   0.7245000     -0.9587000      4.0500000E-02
 C  -0.7201000     -0.9582000     -4.3000001E-02
 C    2.881000      -1.272500      -1.002500    
 C   -2.742000     -0.6462000      -1.327900    
 C    2.745500     -0.6448000       1.326700    
 C   -2.875900      -1.270300       1.002300    
 C    1.488400      -1.272500      -1.083500    
 C   -1.349400     -0.6462000      -1.248000    
 C    1.353000     -0.6450000       1.245600    
 C   -1.483200      -1.270300       1.082200    
 H    5.677500       2.836900       1.071300    
 H    5.234300       3.625400     -0.4423000    
 H   -5.682800       2.834600      -1.074200    
 H   -5.237400       3.625700      0.4374000    
 H    3.958400       1.521200     -4.2800002E-02
 H    4.896900       1.418400      -1.532200    
 H   -3.961200       1.521300      3.9000001E-02
 H   -4.897200       1.420500       1.530100    
 H    7.743900       3.467800      5.9599999E-02
 H    7.266300       2.880100      -1.535900    
 H   -7.747900       3.466100     -6.0100000E-02
 H   -7.267400       2.881000       1.535600    
 H    8.864600       1.275800     -0.1192000    
 H   -8.867000       1.273800      0.1240000    
 H    7.531900     -0.6803000      0.3238000    
 H   -7.534200     -0.6824000     -0.3182000    
 H    3.468200      -1.524100      -1.881600    
 H   -3.223300     -0.3947000      -2.269600    
 H    3.226900     -0.3919000       2.267700    
 H   -3.461700      -1.520900       1.883000    
 H    1.043300      -1.552600      -2.034200    
 H  -0.7978000     -0.3670000      -2.141400    
 H   0.8009000     -0.3641000       2.138300    
 H   -1.037600      -1.549400       2.033000    


%chk=000142979-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000142979

0 1
O 5.277983 -0.693970 2.312866
O -5.277510 -0.697683 -2.311715
N 5.983784 0.197210 0.275533
N -5.983714 0.195647 -0.275502
C 6.843144 2.115406 -1.066583
C -6.844125 2.115072 1.064229
C 5.753777 1.027050 -0.938210
C -5.754209 1.027103 0.937241
C 8.250037 1.477954 -1.143775
C -8.250712 1.477036 1.142077
C 8.398795 0.413603 -0.073292
C -8.398871 0.411376 0.072820
C 7.334145 -0.113492 0.593010
C -7.333907 -0.116024 -0.592740
C 4.977272 -0.223832 1.168102
C -4.976978 -0.226088 -1.167507
C 3.535162 -0.136120 0.747096
C -3.534891 -0.137687 -0.746526
C 0.728461 -0.144206 0.154589
C -0.728157 -0.144549 -0.154066
C 3.067171 -0.489413 -0.545830
C -2.580145 0.183754 -1.746358
C 2.580314 0.185716 1.746704
C -3.066744 -0.490104 0.546591
C 1.688529 -0.496524 -0.833793
C -1.205436 0.193688 -1.452071
C 1.205610 0.195015 1.452390
C -1.688098 -0.496595 0.834536
H 6.787419 2.786574 -0.189117
H 6.634181 2.723388 -1.966091
H -6.788662 2.785220 0.185967
H -6.635526 2.724230 1.963025
H 4.754435 1.484378 -0.873379
H 5.780424 0.379363 -1.838151
H -4.755112 1.484884 0.871914
H -5.780575 0.380515 1.837981
H 9.025756 2.256961 -1.012194
H 8.422579 1.044430 -2.151475
H -9.026796 2.255516 1.009533
H -8.423121 1.044599 2.150266
H 9.402119 0.072031 0.202200
H -9.402009 0.069030 -0.202387
H 7.438860 -0.819294 1.420302
H -7.438217 -0.822858 -1.419204
H 3.775767 -0.803093 -1.319635
H -2.938466 0.415288 -2.754467
H 2.938547 0.418000 2.754672
H -3.775204 -0.803620 1.320581
H 1.351201 -0.818818 -1.824944
H -0.492626 0.485875 -2.231035
H 0.492688 0.487464 2.231153
H -1.350646 -0.818202 1.825868


