%chk=000042407.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042407

0 1
 N   0.5121000     -0.3519000     -0.1647000    
 N   -4.025300     -0.9170000      0.3405000    
 C  -0.1392000      0.8891000     -0.1924000    
 C   -1.510800      0.6415000     -0.3680000    
 C   -1.692000     -0.7577000     -0.4084000    
 C  -0.4564000      -1.336000     -0.2820000    
 C   0.3511000       2.212300     -0.1200000    
 C    1.801200       2.557300      6.0699999E-02
 C    1.918900     -0.6171000     -6.5800004E-02
 C    2.460700       1.634900       1.072400    
 C    2.837700      0.3052000      0.4709000    
 C   -2.983600      -1.466900     -0.5366000    
 C   -2.415400       1.717500     -0.4694000    
 C  -0.5814000       3.262100     -0.2513000    
 C  -0.2554000      -2.797500     -9.8200001E-02
 C   -1.938800       3.023100     -0.4160000    
 C    2.397800      -1.860000     -0.5313000    
 C    4.204400     -4.6999998E-02  0.5200000    
 C    3.754400      -2.183600     -0.4747000    
 C    4.659800      -1.276100      5.0600000E-02
 C   -3.611900      -1.014100       1.737700    
 C   -5.288100      -1.618100      0.1259000    
 H    2.308300       2.531000     -0.9114000    
 H    1.881600       3.583700      0.4407000    
 H    1.829800       1.468800       1.955400    
 H    3.362900       2.139200       1.442500    
 H   -3.308000      -1.349200      -1.580000    
 H   -2.893100      -2.545900     -0.3774000    
 H   -3.478800       1.552400     -0.6160000    
 H  -0.2390000       4.295000     -0.2169000    
 H   -1.126400      -3.260600      0.3777000    
 H  -0.1227000      -3.308900      -1.056600    
 H   0.5508000      -3.042100      0.5989000    
 H   -2.629800       3.856000     -0.5080000    
 H    1.802600      -2.560700      -1.099500    
 H    4.934300      0.6443000      0.9370000    
 H    4.104000      -3.131500     -0.8737000    
 H    5.717100      -1.518800      9.2699997E-02
 H   -2.744700     -0.3879000       1.969300    
 H   -3.382400      -2.045600       2.030700    
 H   -4.413100     -0.6530000       2.393700    
 H   -6.080900      -1.179600      0.7424000    
 H   -5.218300      -2.685600      0.3651000    
 H   -5.613100      -1.518500     -0.9158000    


%chk=000042407-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042407

0 1
N 0.546315 -0.373663 -0.031202
N -4.104036 -0.968135 0.376077
C -0.096508 0.886592 -0.212819
C -1.493106 0.627289 -0.425760
C -1.699442 -0.804755 -0.315023
C -0.459177 -1.391818 -0.063985
C 0.420191 2.207568 -0.160828
C 1.852256 2.532113 0.237374
C 1.961261 -0.619807 -0.084061
C 2.433122 1.514387 1.265844
C 2.886399 0.240947 0.578484
C -3.015099 -1.523632 -0.473356
C -2.391591 1.698571 -0.657504
C -0.504865 3.252072 -0.398667
C -0.172798 -2.833318 0.272908
C -1.880615 3.009644 -0.663429
C 2.447224 -1.721171 -0.838157
C 4.266818 -0.063974 0.498017
C 3.825148 -2.011922 -0.893658
C 4.746481 -1.185769 -0.212703
C -3.803641 -1.035252 1.818712
C -5.409789 -1.569368 0.046989
H 2.522098 2.559006 -0.645369
H 1.869554 3.548010 0.674596
H 1.660927 1.305825 2.031280
H 3.296310 1.970375 1.783427
H -3.358330 -1.433745 -1.524865
H -2.869942 -2.620230 -0.285120
H -3.457751 1.491269 -0.786872
H -0.143874 4.286972 -0.346062
H -1.029924 -3.255353 0.825887
H -0.018018 -3.471360 -0.618194
H 0.724078 -2.930697 0.907436
H -2.550887 3.859270 -0.835763
H 1.743776 -2.333119 -1.408251
H 4.975925 0.599625 1.007585
H 4.174432 -2.867490 -1.481948
H 5.819788 -1.400271 -0.248885
H -2.850809 -0.518294 2.022025
H -3.721230 -2.085259 2.204104
H -4.602170 -0.524297 2.385967
H -6.205196 -1.075330 0.633246
H -5.461085 -2.669454 0.258740
H -5.631320 -1.419553 -1.025515


