%chk=000020972.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020972

0 1
 N    4.367800      0.3235000      2.1900000E-02
 N   -4.364400     -0.3315000      1.8000000E-03
 C   0.6121000     -0.4220000      3.7099998E-02
 C  -0.6389000      0.4596000      2.3300000E-02
 C    1.919000      0.3768000      6.5200001E-02
 C   -1.914200     -0.3878000      2.6799999E-02
 C    3.166200     -0.5041000      7.9999998E-04
 C   -3.161900      0.4925000     -2.3200000E-02
 C    5.566400     -0.5011000     -2.8400000E-02
 C   -5.562100      0.4958000     -3.4800000E-02
 C    6.816300      0.3769000      1.9000000E-03
 C   -6.813300     -0.3800000      1.1000000E-03
 C    8.088200     -0.4712000     -2.8600000E-02
 C   -8.083900      0.4707000     -1.5100000E-02
 C    9.336700      0.3965000     -3.4299999E-02
 C   -9.334100     -0.3946000     -1.5300000E-02
 H   0.5812000      -1.085100      0.9106000    
 H   0.6056000      -1.067200     -0.8503000    
 H  -0.6323000       1.119100      0.8993000    
 H  -0.6228000       1.101300     -0.8659000    
 H    1.923400       1.076100     -0.7811000    
 H    1.944600      0.9857000      0.9782000    
 H   -1.934800      -1.012200      0.9290000    
 H   -1.904200      -1.066400     -0.8356000    
 H    3.136600      -1.108400     -0.9140000    
 H    3.164300      -1.188500      0.8575000    
 H   -3.155800       1.171500      0.8381000    
 H   -3.139300       1.103800     -0.9337000    
 H    4.357200      0.9675000     -0.7686000    
 H   -4.361100     -0.9714000     -0.7920000    
 H    5.587600      -1.183800      0.8297000    
 H    5.571800      -1.109000     -0.9415000    
 H   -5.575200       1.174100      0.8270000    
 H   -5.573500       1.108300     -0.9448000    
 H    6.811500       1.059300     -0.8576000    
 H    6.813700      0.9981000      0.9067000    
 H   -6.816800      -1.058000     -0.8620000    
 H   -6.804800      -1.005600      0.9027000    
 H    8.090700      -1.107600     -0.9212000    
 H    8.114500      -1.134900      0.8435000    
 H   -8.092100       1.111600     -0.9044000    
 H   -8.101900       1.130100      0.8604000    
 H    9.381700       1.024900      0.8609000    
 H    10.23380     -0.2302000     -5.5000000E-02
 H    9.357600       1.048400     -0.9135000    
 H   -9.373200      -1.027300      0.8771000    
 H   -10.23010      0.2340000     -2.5699999E-02
 H   -9.363100      -1.042000     -0.8975000    


%chk=000020972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020972

0 1
N 4.440870 0.223430 -0.018837
N -4.441018 -0.222262 -0.017197
C 0.623878 -0.455336 -0.018011
C -0.624018 0.455830 -0.015599
C 1.950970 0.335254 -0.013811
C -1.951346 -0.334056 -0.012166
C 3.194835 -0.574190 -0.015446
C -3.195047 0.575497 -0.011440
C 5.688611 -0.571867 -0.007436
C -5.688954 0.572685 -0.003248
C 6.930882 0.339720 -0.006195
C -6.930983 -0.339224 -0.004768
C 8.260075 -0.448701 -0.001564
C -8.260380 0.448804 0.003313
C 9.499977 0.471187 -0.000351
C -9.500023 -0.471433 0.001727
H 0.590594 -1.122342 0.868571
H 0.590447 -1.118922 -0.907603
H -0.589151 1.119954 0.873151
H -0.591642 1.122637 -0.902902
H 1.981813 1.000022 -0.904092
H 1.999076 0.995862 0.873581
H -1.999250 -0.996540 0.873881
H -1.983015 -0.997401 -0.903582
H 3.131837 -1.283304 -0.882354
H 3.193858 -1.199534 0.900403
H -3.194366 1.198282 0.906152
H -3.131995 1.287096 -0.876292
H 4.443119 0.901554 -0.795623
H -4.443141 -0.898122 -0.795955
H 5.687959 -1.192703 0.911561
H 5.755388 -1.285188 -0.870644
H -5.688423 1.190603 0.917718
H -5.755954 1.288703 -0.864191
H 6.904007 1.000035 -0.899951
H 6.880153 1.005079 0.877613
H -6.904325 -0.996347 -0.900885
H -6.879679 -1.007717 0.876644
H 8.294371 -1.116962 -0.886395
H 8.288013 -1.110053 0.888516
H -8.295276 1.120302 -0.879038
H -8.288103 1.106869 0.895835
H 9.501537 1.131094 0.887567
H 10.438570 -0.112834 0.009835
H 9.513646 1.118459 -0.897716
H -9.500847 -1.134750 0.887100
H -10.438769 0.112284 0.014741
H -9.514078 -1.115255 -0.898114


