%chk=000056621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056621

0 1
 S    2.522400      -1.704400      0.5987000    
 S    5.125300     -0.1283000      0.4963000    
 N  -5.0700001E-02  -1.544700     -9.2500001E-02
 N   -1.280900      0.4357000      9.8999999E-03
 N   -2.461600      -1.446500     -4.6399999E-02
 N    1.395900      0.2705000     -0.5828000    
 N    2.722900      0.6332000     -0.4319000    
 C   -1.253200     -0.9300000     -4.6500001E-02
 C   -2.594800      0.8265000      4.8700001E-02
 C   -3.311800     -0.3663000      1.2500000E-02
 C   -3.199100       2.082500      0.1106000    
 C   -4.715900     -0.3222000      3.8899999E-02
 C    1.203300     -0.9018000     -8.8299997E-02
 C  -3.8899999E-02  -3.019500     -0.2753000    
 C   -4.597400       2.107600      0.1361000    
 C   -5.344300      0.9278000      0.1009000    
 C    3.420100     -0.3071000      0.1694000    
 C    5.496500       1.524500     -0.1771000    
 C    6.962200       1.862700      1.8700000E-02
 H  -0.4851000       1.058900      2.3800001E-02
 H   -2.617200       2.996800      0.1378000    
 H   -5.305200      -1.233300      1.1900000E-02
 H   0.7243000      -3.329100     -0.9992000    
 H  -0.9935000      -3.388000     -0.6697000    
 H   0.1365000      -3.520800      0.6830000    
 H   -5.112000       3.064200      0.1842000    
 H   -6.429800      0.9794000      0.1220000    
 H    5.253700       1.542100      -1.244400    
 H    4.875400       2.269000      0.3312000    
 H    7.233100       1.875800       1.079900    
 H    7.611900       1.148100     -0.4979000    
 H    7.173300       2.856800     -0.3891000    


%chk=000056621-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056621

0 1
S 2.737672 -2.017997 -0.068264
S 5.357366 -0.271725 -0.064219
N -0.050428 -1.643416 -0.052695
N -1.262572 0.492040 -0.027495
N -2.472847 -1.459902 -0.041826
N 1.380376 0.302295 -0.040647
N 2.735024 0.670605 -0.043253
C -1.249440 -0.898604 -0.041086
C -2.611486 0.878595 -0.019062
C -3.355627 -0.355124 -0.028063
C -3.239549 2.139103 -0.005142
C -4.768218 -0.326778 -0.022771
C 1.185123 -1.030160 -0.052149
C -0.156411 -3.121119 -0.065529
C -4.652263 2.145374 -0.000084
C -5.402937 0.933524 -0.008740
C 3.565418 -0.363642 -0.056599
C 5.555942 1.630210 -0.045306
C 7.053072 1.956694 -0.052443
H -0.380841 1.033173 -0.026436
H -2.668199 3.072780 0.001713
H -5.341237 -1.258812 -0.029434
H 0.318937 -3.532879 -0.973668
H -1.228309 -3.367954 -0.064408
H 0.324473 -3.549037 0.832164
H -5.183590 3.103435 0.010762
H -6.497254 0.985358 -0.004346
H 5.029182 2.012497 -0.933089
H 5.041793 1.993406 0.857777
H 7.565909 1.546723 0.835368
H 7.552750 1.567139 -0.956788
H 7.183571 3.054299 -0.040841


