%chk=000090748.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090748

0 1
 O   -5.053800      -2.223400     -0.9709000    
 N    1.120000      0.7540000      0.3372000    
 C   -1.445500       1.172400      -1.023300    
 C  -0.8387000       2.192900     -1.1800000E-02
 C  -1.1700000E-02   1.407100       1.029700    
 C  -0.2544000      0.4437000      -1.706300    
 C  -0.9334000      0.4731000       1.843500    
 C   -2.294200      0.1168000     -0.2968000    
 C   0.7227000     -0.1906000     -0.7077000    
 C   -2.018400     -0.2171000       1.048300    
 C   -2.235900       1.931700      -2.111800    
 C   -1.868700       3.124700      0.6471000    
 C    2.093800      0.1600000       1.247600    
 C   -3.317000     -0.5853000     -0.9604000    
 C   -2.785500      -1.199400       1.697900    
 C   -4.066900      -1.563700     -0.3046000    
 C    3.347100     -0.2647000      0.5293000    
 C   -3.804100      -1.868100       1.025200    
 C    3.434400      -1.547800      7.4000000E-03
 C    4.397800      0.6328000      0.3992000    
 C    4.595600      -1.941100     -0.6578000    
 C    5.558900      0.2396000     -0.2663000    
 C    5.657800      -1.047500     -0.7949000    
 H  -0.1487000       2.855900     -0.5564000    
 H   0.4245000       2.134200       1.728200    
 H   0.3008000       1.164200      -2.323600    
 H  -0.6162000     -0.3338000      -2.392000    
 H   -1.434400       1.077600       2.612300    
 H  -0.3493000     -0.2756000       2.389200    
 H   0.2929000      -1.105900     -0.2835000    
 H    1.573900     -0.4911000      -1.324800    
 H   -1.655100       2.776000      -2.501700    
 H   -2.469300       1.291100      -2.969600    
 H   -3.183800       2.324200      -1.727200    
 H   -1.390700       3.739700       1.417400    
 H   -2.298400       3.811600     -8.9100003E-02
 H   -2.695300       2.583100       1.115300    
 H    1.681800     -0.7063000       1.780600    
 H    2.372000      0.8820000       2.027000    
 H   -3.539700     -0.3861000      -2.005100    
 H   -2.586400      -1.448500       2.737700    
 H   -4.380500      -2.626000       1.548400    
 H    2.621600      -2.260200      0.1184000    
 H    4.330600       1.638300      0.8051000    
 H   -5.467700      -2.864500     -0.3679000    
 H    4.674000      -2.944300      -1.066500    
 H    6.385800      0.9356000     -0.3733000    
 H    6.562100      -1.354000      -1.312500    


%chk=000090748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090748

0 1
O -5.373281 -1.816725 -1.189384
N 1.098024 0.533154 0.313952
C -1.462986 1.236154 -0.986219
C -0.780427 2.144155 0.091627
C 0.020625 1.242231 1.063884
C -0.316352 0.465986 -1.729847
C -0.955593 0.316213 1.852839
C -2.385515 0.206842 -0.300957
C 0.594502 -0.332028 -0.781770
C -2.103006 -0.254110 1.021228
C -2.212255 2.105823 -2.027039
C -1.761165 3.070697 0.843233
C 2.082105 -0.151066 1.178958
C -3.485607 -0.345038 -0.999457
C -2.935941 -1.245721 1.593515
C -4.301022 -1.332693 -0.411237
C 3.418930 -0.410192 0.483369
C -4.031792 -1.795298 0.897675
C 4.164803 -1.577970 0.777278
C 3.954660 0.531330 -0.430833
C 5.427427 -1.798633 0.180042
C 5.213141 0.312267 -1.033059
C 5.956630 -0.852777 -0.727761
H -0.036265 2.772675 -0.439956
H 0.537286 1.893218 1.797880
H 0.294964 1.209364 -2.279085
H -0.759856 -0.222667 -2.474802
H -1.382222 0.898201 2.695887
H -0.385462 -0.509545 2.323148
H 0.046207 -1.221314 -0.385352
H 1.465958 -0.716298 -1.343007
H -1.560493 2.934774 -2.361831
H -2.483236 1.521352 -2.925490
H -3.139589 2.540368 -1.614770
H -1.239347 3.613772 1.654237
H -2.192948 3.826862 0.164401
H -2.598691 2.506761 1.291796
H 1.702698 -1.124593 1.583255
H 2.255414 0.504228 2.057690
H -3.734419 -0.017030 -2.012236
H -2.720908 -1.597241 2.610636
H -4.659919 -2.565220 1.364441
H 3.754469 -2.320687 1.473811
H 3.360132 1.421479 -0.665418
H -5.886035 -2.499666 -0.690283
H 5.992208 -2.707929 0.416313
H 5.615405 1.047465 -1.739904
H 6.933144 -1.023629 -1.195199


