%chk=000149478.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149478

0 1
 O   -3.932700      -3.878700     -0.6060000    
 N   -3.580300       1.439200      0.6718000    
 N    4.006600      -1.947700      0.5192000    
 N    2.414400      0.6859000      -1.187700    
 N    2.510000       2.967600     -0.6230000    
 C   -1.683400      0.5477000     -8.5199997E-02
 C   -2.266600       1.723500      0.3810000    
 C   -1.560700       2.927600      0.4970000    
 C   0.4101000       1.768900     -0.3501000    
 C   -2.692700     -0.4670000     -6.7900002E-02
 C  -0.2053000       2.943800      0.1250000    
 C  -0.3230000      0.5709000     -0.4567000    
 C   -3.864700      0.1201000      0.4092000    
 C    4.242400     -0.8380000      -1.684100    
 C    3.648400      -2.007400     -0.8927000    
 C    1.758100       1.846800     -0.7043000    
 C    3.833300      0.5450000      -1.178800    
 C   -2.716300      -1.834100     -0.4154000    
 C   -2.248700       4.156500       1.004800    
 C   0.5556000       4.114600      0.2167000    
 C    5.460500      -1.994200      0.6849000    
 C    3.376500      -3.043400       1.258000    
 C   -5.061500     -0.5901000      0.5573000    
 C   -3.905700      -2.557700     -0.2728000    
 C    1.888100       4.073000     -0.1640000    
 C   -5.059800      -1.942800      0.2066000    
 C    5.850800      -1.866000       2.147500    
 C    1.865700      -3.014600       1.100100    
 C   -2.719000      -4.449500      -1.090500    
 H   0.1243000     -0.3536000     -0.8090000    
 H   -4.254200       2.100900       1.030000    
 H    5.333300     -0.9031000      -1.755100    
 H    3.891900     -0.9400000      -2.721000    
 H    3.987300      -2.948800      -1.345700    
 H    2.565300      -1.963200      -1.040200    
 H    4.289300       1.298000      -1.832900    
 H    4.229700      0.7109000     -0.1705000    
 H    1.882000      0.1165000      -1.837000    
 H   -1.790000      -2.259900     -0.7818000    
 H   -3.300000       3.987700       1.253000    
 H   -2.226700       4.947200      0.2470000    
 H   -1.762800       4.516100       1.918300    
 H   0.1505000       5.055900      0.5729000    
 H    5.892000      -2.911400      0.2647000    
 H    5.942000      -1.147500      0.1874000    
 H    3.760300      -4.022900      0.9461000    
 H    3.563100      -2.940700       2.331800    
 H   -5.960700     -0.1117000      0.9307000    
 H    2.508800       4.961200     -0.1064000    
 H   -5.977000      -2.517300      0.3125000    
 H    6.926700      -1.671700       2.224200    
 H    5.660200      -2.782600       2.714100    
 H    5.333900      -1.031600       2.634200    
 H    1.407700      -3.669300       1.850400    
 H    1.537200      -3.388000      0.1251000    
 H    1.457600      -2.009800       1.255500    
 H   -2.403400      -3.987100      -2.031900    
 H   -1.930500      -4.426200     -0.3304000    
 H   -2.921800      -5.503800      -1.306200    


%chk=000149478-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149478

0 1
O -5.060199 -3.535731 -1.859580
N -4.050402 1.440563 0.510921
N 4.910626 -1.851053 0.725765
N 2.088734 0.134480 -1.058400
N 2.419639 2.147851 0.080427
C -2.162107 0.372939 -0.273838
C -2.654834 1.562433 0.393957
C -1.812959 2.596204 0.828943
C 0.105491 1.268511 -0.114545
C -3.318483 -0.474824 -0.549124
C -0.404828 2.443884 0.578147
C -0.790200 0.237533 -0.518503
C -4.469088 0.218024 -0.050875
C 3.911594 -1.477360 -1.555584
C 3.866418 -2.285490 -0.236718
C 1.550930 1.203210 -0.358357
C 3.524847 0.001954 -1.359512
C -3.464051 -1.741427 -1.166769
C -2.350364 3.821903 1.543861
C 0.549804 3.428633 1.015294
C 6.229051 -2.483672 0.456228
C 4.487812 -1.962975 2.147962
C -5.764284 -0.330933 -0.157850
C -4.763040 -2.288874 -1.271819
C 1.905050 3.225786 0.767124
C -5.900097 -1.589764 -0.772155
C 7.419118 -1.654489 0.977434
C 3.466146 -0.884912 2.558650
C -3.938808 -4.307247 -2.391560
H -0.425615 -0.675345 -1.003476
H -4.666253 2.124026 0.942455
H 4.932245 -1.514720 -1.982665
H 3.244069 -1.957783 -2.304384
H 3.947631 -3.377996 -0.464775
H 2.876505 -2.131514 0.229454
H 3.787852 0.594941 -2.261102
H 4.089870 0.425819 -0.514141
H 1.453334 -0.477943 -1.568670
H -2.587419 -2.273593 -1.547482
H -3.450097 3.806249 1.636959
H -2.082547 4.751568 1.007457
H -1.937141 3.906805 2.566855
H 0.224580 4.325938 1.547113
H 6.277403 -3.521483 0.877320
H 6.332324 -2.590426 -0.640194
H 4.077959 -2.981806 2.372877
H 5.390579 -1.845876 2.774875
H -6.646661 0.195127 0.221431
H 2.651871 3.952055 1.108528
H -6.880830 -2.062284 -0.881266
H 8.375702 -2.145924 0.717816
H 7.392327 -1.536560 2.075769
H 7.403732 -0.646113 0.528515
H 3.222081 -0.976736 3.633767
H 2.520728 -0.967289 1.992506
H 3.876476 0.122027 2.369330
H -3.416595 -3.757584 -3.200107
H -3.213257 -4.568784 -1.595460
H -4.386270 -5.225852 -2.799130


