%chk=000129980.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129980

0 1
 O   -2.861000       1.506100      0.1384000    
 O   -8.546200      -1.449400      -1.568000    
 O   -8.888000      -2.390900      0.4643000    
 O    2.106000     -0.8605000     -0.3237000    
 N    9.489000      9.8200001E-02 -5.5300001E-02
 N    11.19870     -8.0600001E-02   1.350900    
 C   -8.996700      4.6000000E-02  0.2533000    
 C   -7.736100      0.8790000     -0.1045000    
 C   -6.417900      0.3358000      0.4652000    
 C   -5.231200       1.187700      1.4600000E-02
 C   -9.267200      9.6400000E-02   1.766200    
 C   -10.20420      0.6378000     -0.4946000    
 C   -8.831100      -1.393100     -0.2427000    
 C   -3.921800      0.6843000      0.6055000    
 C    5.688000      0.2968000     -0.7152000    
 C    7.009100     -0.2437000     -0.1598000    
 C    4.500500     -0.5427000     -0.2331000    
 C    8.227300      0.5610000     -0.6204000    
 C    3.175200     -4.0500000E-02 -0.7929000    
 C   -1.627900      0.9186000      2.3800001E-02
 C   0.8818000     -0.2771000     -0.2094000    
 C    10.31970     -0.8437000     -0.5938000    
 C  -0.7291000       1.366500     -0.9445000    
 C   -1.271600     -0.1271000      0.8754000    
 C    10.05830      0.5277000       1.111200    
 C   0.5256000      0.7687000      -1.061100    
 C  -1.6899999E-02 -0.7250000      0.7587000    
 C    11.36770     -0.9365000      0.2914000    
 H   -7.875600       1.910300      0.2466000    
 H   -7.636300      0.9441000      -1.196400    
 H   -6.260500     -0.6985000      0.1400000    
 H   -6.458400      0.3308000       1.559900    
 H   -5.381500       2.234400      0.3074000    
 H   -5.159900       1.189500      -1.080300    
 H   -10.20800     -0.4102000       2.011500    
 H   -8.480200     -0.4085000       2.336000    
 H   -9.339600       1.129100       2.124100    
 H   -10.04050      0.6730000      -1.577700    
 H   -11.10630      3.8800001E-02 -0.3228000    
 H   -10.41190       1.660400     -0.1596000    
 H   -3.792900     -0.3600000      0.2926000    
 H   -3.959200      0.7341000       1.699900    
 H    5.555700       1.338500     -0.3996000    
 H    5.722800      0.2907000      -1.811100    
 H    7.133200      -1.291200     -0.4627000    
 H    6.968200     -0.2427000      0.9370000    
 H    4.637900      -1.592200     -0.5222000    
 H    4.455100     -0.5383000      0.8632000    
 H    8.120900       1.615700     -0.3406000    
 H    8.328100      0.5186000      -1.711200    
 H    3.196700     -7.9499997E-02  -1.888300    
 H    3.051100       1.001400     -0.4693000    
 H   -8.412300      -2.371500      -1.874700    
 H    10.10240      -1.349200      -1.524400    
 H   -1.004200       2.176700      -1.614200    
 H   -1.930400     -0.4872000       1.660000    
 H    9.599700       1.278300       1.740400    
 H    1.184000       1.129500      -1.845600    
 H   0.2579000      -1.535300       1.428600    
 H    12.23480      -1.576800      0.2202000    


%chk=000129980-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129980

0 1
O -3.039615 1.035181 -0.549812
O -9.217044 -1.462093 -1.546287
O -9.360049 -2.384147 0.571045
O 2.357345 -0.343247 0.377714
N 9.818266 0.014775 -0.242141
N 11.749866 -0.212501 0.933901
C -9.291822 0.101875 0.320774
C -7.990296 0.801557 -0.197526
C -6.660332 0.169116 0.269428
C -5.440598 0.886869 -0.352630
C -9.385610 0.139207 1.864603
C -10.525620 0.821084 -0.302924
C -9.295997 -1.359766 -0.144164
C -4.115390 0.279168 0.112656
C 5.972102 0.480704 -0.496148
C 7.312277 -0.118582 -0.016134
C 4.755049 -0.205500 0.164515
C 8.525547 0.563431 -0.688741
C 3.428517 0.401224 -0.300025
C -1.711649 0.650176 -0.283489
C 1.027232 0.041243 0.110963
C 10.386282 -1.206461 -0.632430
C -0.712023 1.398471 -0.946575
C -1.336313 -0.409729 0.582417
C 10.676483 0.571519 0.705950
C 0.652617 1.100847 -0.755005
C 0.028351 -0.707112 0.774283
C 11.572307 -1.327095 0.097144
H -8.031531 1.858343 0.136588
H -8.016537 0.809150 -1.303760
H -6.638087 -0.903970 -0.011811
H -6.587369 0.207728 1.374291
H -5.453974 1.961195 -0.085095
H -5.490730 0.830030 -1.456887
H -10.340153 -0.293537 2.210916
H -8.575601 -0.437837 2.340387
H -9.328413 1.186450 2.213631
H -10.483916 0.798875 -1.404793
H -11.470025 0.347609 0.021405
H -10.540707 1.875189 0.029879
H -4.050333 -0.793128 -0.170383
H -4.006494 0.359859 1.215340
H 5.952838 1.568185 -0.273049
H 5.898437 0.385043 -1.600020
H 7.335334 -1.204209 -0.233861
H 7.400813 -0.013669 1.082625
H 4.754531 -1.286720 -0.071787
H 4.820979 -0.117922 1.265776
H 8.522613 1.645617 -0.460538
H 8.454488 0.461166 -1.788322
H 3.312900 0.308012 -1.401400
H 3.369808 1.477612 -0.030231
H -9.232648 -2.424790 -1.799169
H 9.919557 -1.851429 -1.372838
H -1.020225 2.212012 -1.610463
H -2.087831 -1.005511 1.108182
H 10.480568 1.529679 1.182769
H 1.403948 1.696629 -1.281267
H 0.336159 -1.520686 1.438300
H 12.302516 -2.132589 0.070826


