%chk=000168411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168411

0 1
 N    2.156400      0.5763000     -0.2516000    
 N   -6.944400      -1.085400     -0.1544000    
 N    6.391700      -1.940800     -0.2106000    
 C  -0.8682000      0.6745000      0.2330000    
 C   -2.320300      0.8398000     -0.2215000    
 C   2.2000000E-03   1.833500     -0.2613000    
 C   -3.186900     -0.3321000      0.2453000    
 C    1.451000       1.759400      0.2270000    
 C   -4.645300     -0.1489000     -0.1856000    
 C    3.523500      0.5488000      0.2490000    
 C    4.284600     -0.6886000     -0.2320000    
 C   -5.563200      -1.286600      0.2665000    
 C    5.718900     -0.7499000      0.2963000    
 H  -0.4757000     -0.2762000     -0.1464000    
 H  -0.8300000      0.6276000       1.328000    
 H   -2.724100       1.778400      0.1772000    
 H   -2.358000      0.9100000      -1.315400    
 H  -1.3600000E-02   1.862500      -1.358300    
 H  -0.4297000       2.781300      8.3800003E-02
 H   -3.137600     -0.4157000       1.337700    
 H   -2.797200      -1.269400     -0.1696000    
 H    1.971200       2.663700     -0.1126000    
 H    1.449800       1.775900       1.323900    
 H   -4.686700     -6.3800000E-02  -1.279200    
 H   -5.022500      0.7993000      0.2187000    
 H    2.159000      0.5647000      -1.270900    
 H    4.062700       1.446000     -7.9200000E-02
 H    3.516600      0.5498000       1.345800    
 H    4.301300     -0.6976000      -1.330000    
 H    3.741600      -1.589700      8.3200000E-02
 H   -5.200300      -2.236900     -0.1410000    
 H   -5.536500      -1.368000       1.358600    
 H    6.274400      0.1385000     -2.2100000E-02
 H    5.717700     -0.7695000       1.391600    
 H   -6.988300      -1.033000      -1.171300    
 H   -7.501800      -1.894900      0.1152000    
 H    7.327600      -1.995700      0.1891000    
 H    5.897300      -2.774700      0.1043000    


%chk=000168411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168411

0 1
N 2.165824 0.734794 -0.148014
N -6.824142 -1.376436 -0.394066
N 6.205470 -2.146412 -0.375040
C -0.876768 0.893775 0.391054
C -2.288298 0.872827 -0.236028
C 0.021596 2.016182 -0.174342
C -3.198977 -0.230878 0.348026
C 1.478948 1.955898 0.330692
C -4.598184 -0.272543 -0.305417
C 3.559499 0.581356 0.320373
C 4.192786 -0.702571 -0.248955
C -5.504387 -1.377678 0.273267
C 5.651444 -0.906038 0.206885
H -0.372839 -0.078304 0.227704
H -0.964155 1.019224 1.490900
H -2.774879 1.861099 -0.094392
H -2.197438 0.727122 -1.333392
H 0.022158 1.965119 -1.285049
H -0.404777 3.005726 0.088067
H -3.308363 -0.073689 1.441667
H -2.701143 -1.215732 0.224378
H 2.014287 2.892665 0.027703
H 1.484291 1.935702 1.439780
H -4.484415 -0.430155 -1.399857
H -5.111953 0.700192 -0.179132
H 2.111890 0.662393 -1.175317
H 4.204839 1.459833 0.054090
H 3.542773 0.529460 1.428254
H 4.178379 -0.679354 -1.356977
H 3.573650 -1.567923 0.062473
H -4.962536 -2.354490 0.204052
H -5.667409 -1.180890 1.350950
H 6.265424 -0.057179 -0.152630
H 5.684222 -0.875253 1.325213
H -6.768729 -1.527042 -1.407202
H -7.520657 -1.988942 0.042050
H 7.212059 -2.270812 -0.228943
H 5.677710 -2.988448 -0.121626


