%chk=000059517.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059517

1 1
 O  -0.4931000      -3.024500      0.6568000    
 N    1.720900       1.421300      0.1410000    
 C   0.5237000     -0.8124000      0.3112000    
 C    1.497600      0.2116000      0.9736000    
 C    1.105700      -1.334500      -1.045900    
 C   0.3551000      -2.047100       1.250200    
 C  -0.8819000     -0.1965000      6.8999998E-02
 C   0.3902000       2.116500     -0.1762000    
 C    2.622700       2.425100      0.8715000    
 C    2.395100       1.051000      -1.186700    
 C    2.465400      -2.020900     -0.9520000    
 C   -1.366800     -0.2025000      -1.206900    
 C   -1.546900      0.3129000       1.146700    
 C   -2.628900      0.3503000      -1.424500    
 C   -2.809000      0.8655000      0.9290000    
 C   -3.349900      0.8841000     -0.3567000    
 H    2.474500     -0.2335000       1.192000    
 H    1.104200      0.5531000       1.939600    
 H    1.086000     -0.6764000      -1.902200    
 H   0.4453000      -2.136900      -1.412700    
 H    1.317600      -2.514900       1.485700    
 H  -9.1300003E-02  -1.766300       2.209800    
 H  -7.6399997E-02   1.729000      -1.072100    
 H  -0.1893000       2.253300      0.7350000    
 H   0.6599000       3.138300     -0.4807000    
 H    2.765100       3.308300      0.2414000    
 H    2.131800       2.702400       1.809200    
 H    3.581300       1.936600       1.070200    
 H    3.153600      0.2892000      -1.051400    
 H    1.683000      0.9721000      -2.004700    
 H    2.969500       1.940400      -1.484300    
 H    2.926800      -2.070200      -1.944600    
 H    2.342100      -3.057900     -0.6184000    
 H    3.180100      -1.562300     -0.2688000    
 H  -0.8910000     -0.6062000      -2.087900    
 H   -1.147200      0.3029000       2.154400    
 H   5.9799999E-02  -3.599000      0.1012000    
 H   -3.053100      0.3625000      -2.424500    
 H   -3.371200       1.280200       1.760500    
 H   -4.333000       1.313600     -0.5259000    


%chk=000059517-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059517

1 1
O -0.374483 -3.103046 0.924967
N 1.738314 1.596718 0.169443
C 0.516244 -0.858400 0.180600
C 1.471685 0.195663 0.829847
C 1.149841 -1.614979 -1.033365
C 0.350172 -1.921287 1.354454
C -0.881879 -0.273797 -0.156156
C 0.627899 2.597867 0.499753
C 3.043851 2.124800 0.771538
C 1.894923 1.527876 -1.345513
C 2.536044 -2.259820 -0.804133
C -1.406383 -0.274368 -1.474858
C -1.699661 0.263038 0.878045
C -2.688890 0.254462 -1.753220
C -2.979108 0.790090 0.605982
C -3.480664 0.792501 -0.716643
H 2.474018 -0.254557 0.933517
H 1.110719 0.453326 1.842660
H 1.215590 -0.963557 -1.920558
H 0.427994 -2.405666 -1.310697
H 1.345213 -2.178564 1.775462
H -0.261869 -1.490300 2.162502
H -0.325556 2.228181 0.103003
H 0.558129 2.704592 1.593146
H 0.886982 3.567397 0.045653
H 3.204512 3.159091 0.430011
H 2.968406 2.103532 1.869439
H 3.879481 1.489043 0.441518
H 2.665599 0.786237 -1.599725
H 0.928956 1.251721 -1.789686
H 2.201728 2.522346 -1.706664
H 2.830879 -2.827962 -1.703611
H 2.549380 -2.972017 0.041221
H 3.339862 -1.520643 -0.621120
H -0.841568 -0.714446 -2.301881
H -1.352811 0.266903 1.919325
H 0.244146 -3.788310 0.569953
H -3.072366 0.229425 -2.778698
H -3.589730 1.184029 1.425202
H -4.477598 1.191081 -0.929816


