%chk=000060555.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060555

0 1
 N   -4.526900      0.7510000      0.2500000    
 N    2.297100      0.2025000      0.2786000    
 C   -4.613800     -0.2556000     -0.8173000    
 C   -5.833100      0.9607000      0.8901000    
 C   -5.619700      0.1637000      -1.890400    
 C   -6.878900       1.419900     -0.1273000    
 C   -6.992800      0.4373000      -1.287200    
 C   -3.527600      0.3582000       1.243300    
 C   -2.147100      0.2583000      0.5966000    
 C   -1.080400     -0.1312000       1.625500    
 C   0.2795000     -0.2732000       1.009600    
 C   0.8193000      -1.457900      0.4695000    
 C    2.098300      -1.133400      1.2000000E-02
 C    1.191100      0.7322000      0.8871000    
 C   0.3599000      -2.781100      0.3167000    
 C    3.451700      0.9314000     -1.7500000E-02
 C    2.944200      -2.069900     -0.5928000    
 C    1.195100      -3.728600     -0.2865000    
 C    2.467000      -3.376200     -0.7334000    
 C    3.351300       2.288200     -0.2913000    
 C    4.681500      0.2883000     -2.9899999E-02
 C    4.504200       3.016800     -0.5838000    
 C    5.834400       1.017100     -0.3223000    
 C    5.745700       2.381400     -0.5992000    
 H   -4.891200      -1.237600     -0.4123000    
 H   -3.669500     -0.3720000      -1.354500    
 H   -5.748600       1.733900       1.663500    
 H   -6.178500      4.2399999E-02   1.383300    
 H   -5.701200     -0.6222000      -2.650000    
 H   -5.259300       1.065900      -2.401100    
 H   -6.606200       2.410500     -0.5129000    
 H   -7.852500       1.525600      0.3645000    
 H   -7.667900      0.8350000      -2.052800    
 H   -7.429100     -0.5032000     -0.9288000    
 H   -3.792700     -0.5962000       1.716800    
 H   -3.483100       1.114000       2.037600    
 H   -1.879600       1.212400      0.1241000    
 H   -2.113100     -0.5092000     -0.1822000    
 H   -1.040900      0.6277000       2.417700    
 H   -1.361000      -1.071600       2.116100    
 H    1.135700       1.764800       1.206900    
 H  -0.6297000      -3.072100      0.6571000    
 H    3.898900      -1.839000      -1.045500    
 H   0.8439000      -4.749400     -0.4119000    
 H    3.089700      -4.123500      -1.219000    
 H    2.401100       2.814000     -0.3125000    
 H    4.837400     -0.7272000      0.3134000    
 H    4.435400       4.078300     -0.8033000    
 H    6.805300      0.5304000     -0.3032000    
 H    6.644100       2.950000     -0.8206000    


%chk=000060555-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060555

0 1
N -4.650935 0.616663 0.167041
N 2.499545 0.258028 0.264502
C -4.920576 -0.556267 -0.704672
C -5.891150 1.066148 0.853424
C -5.991794 -0.233866 -1.766538
C -6.990435 1.443903 -0.160258
C -7.296639 0.256878 -1.100992
C -3.554294 0.368483 1.136420
C -2.160714 0.259408 0.484436
C -1.041391 0.104674 1.552854
C 0.329012 -0.102982 0.956334
C 0.823712 -1.314946 0.319206
C 2.176927 -1.068289 -0.106117
C 1.364941 0.821411 0.896181
C 0.235188 -2.581156 0.064068
C 3.735607 0.945487 0.058688
C 2.923717 -2.037827 -0.813440
C 0.984915 -3.559316 -0.617074
C 2.311310 -3.283972 -1.060451
C 3.723836 2.313189 -0.320053
C 4.975552 0.284053 0.255887
C 4.938596 3.008732 -0.495358
C 6.185202 0.984223 0.061865
C 6.175824 2.348070 -0.312415
H -5.263922 -1.434664 -0.091453
H -3.982330 -0.852967 -1.205309
H -5.639061 1.940226 1.483536
H -6.286629 0.266144 1.537605
H -6.180168 -1.135382 -2.381165
H -5.600060 0.554675 -2.437883
H -6.640958 2.308193 -0.757721
H -7.901249 1.757839 0.385609
H -8.039306 0.549106 -1.867490
H -7.745171 -0.571702 -0.513879
H -3.747773 -0.555282 1.747391
H -3.542360 1.219199 1.847187
H -1.976025 1.163645 -0.124683
H -2.116536 -0.603539 -0.205807
H -1.036443 1.002886 2.201106
H -1.295802 -0.753155 2.209683
H 1.409423 1.831826 1.298059
H -0.789875 -2.793343 0.388776
H 3.934592 -1.835020 -1.178547
H 0.544993 -4.541941 -0.820637
H 2.866925 -4.053859 -1.607626
H 2.767697 2.816356 -0.499049
H 4.988642 -0.755899 0.595506
H 4.918035 4.063720 -0.790246
H 7.137278 0.465721 0.220751
H 7.117526 2.888085 -0.456750


