%chk=000005709.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005709

0 1
N 3.302279 0.797431 0.572779
N 3.644128 -1.380235 -0.125564
C -3.613042 0.140379 0.548767
C -2.162252 0.137835 0.008539
C 0.542688 0.059915 -0.972107
C -0.161953 -1.155149 -0.694437
C -0.122295 1.305070 -0.785135
C -1.487331 -1.090709 -0.206889
C -1.455106 1.323256 -0.298981
C -3.649383 -0.573578 1.934040
C -4.538166 -0.624728 -0.445548
C -4.176392 1.573303 0.729267
C 1.996101 0.003540 -1.456424
C 2.995724 -0.225322 -0.332786
C 0.478775 -2.513544 -0.933228
C 0.543073 2.637202 -1.110016
C 4.255179 0.305708 1.594922
C 4.511685 -1.171061 1.088209
H -2.001511 -2.036359 0.005452
H -1.939715 2.295867 -0.166127
H -4.683758 -0.594614 2.327210
H -3.290970 -1.615917 1.864415
H -3.010279 -0.044910 2.664957
H -4.201898 -1.666229 -0.595068
H -5.574902 -0.653829 -0.059366
H -4.549366 -0.128462 -1.433352
H -5.208596 1.517934 1.121685
H -3.575173 2.161688 1.447062
H -4.210982 2.123067 -0.229501
H 2.137452 -0.823916 -2.170354
H 2.262087 0.939302 -1.980766
H 1.477650 -2.589851 -0.468358
H -0.160485 -3.322876 -0.540498
H 0.621725 -2.701113 -2.016440
H -0.179959 3.464406 -1.009051
H 0.937008 2.666881 -2.143327
H 1.392293 2.871050 -0.437234
H 3.810635 0.326014 2.609244
H 5.181651 0.910637 1.607482
H 2.836588 1.699965 0.611424
H 5.569164 -1.332549 0.812056
H 4.248430 -1.920603 1.855746


%chk=000005709-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005709

0 1
N 2.840367 0.387851 0.843297
N 4.130455 -0.940957 -0.532275
C -3.592614 0.223153 0.552790
C -2.142246 0.181672 0.012978
C 0.548920 0.026790 -0.990037
C -0.158519 -1.162363 -0.633056
C -0.094171 1.289728 -0.843096
C -1.479407 -1.064169 -0.141195
C -1.422021 1.345064 -0.345117
C -3.634395 -0.409556 1.976819
C -4.520377 -0.592882 -0.397853
C -4.148329 1.667375 0.648739
C 1.985616 -0.068275 -1.497490
C 3.014921 -0.250283 -0.394166
C 0.489090 -2.529900 -0.783033
C 0.607256 2.589710 -1.216858
C 3.918650 -0.041604 1.765494
C 4.883877 -0.784185 0.763715
H -2.000511 -1.991741 0.126040
H -1.891624 2.328786 -0.244594
H -4.669465 -0.402974 2.368170
H -3.281351 -1.456120 1.968508
H -2.995177 0.158065 2.677942
H -4.197436 -1.646286 -0.477153
H -5.560058 -0.583672 -0.019070
H -4.517720 -0.160933 -1.415363
H -5.182654 1.640169 1.038272
H -3.548003 2.292609 1.335490
H -4.174600 2.162175 -0.339669
H 2.117712 -0.914942 -2.191850
H 2.253034 0.842885 -2.062680
H 1.464884 -2.586223 -0.266443
H -0.162147 -3.321498 -0.375201
H 0.683946 -2.771805 -1.846029
H -0.011931 3.460513 -0.941901
H 0.798162 2.652100 -2.305935
H 1.585434 2.697509 -0.711928
H 3.530806 -0.721416 2.551643
H 4.403317 0.820203 2.257444
H 1.922453 0.695150 1.166286
H 5.798194 -0.190505 0.574187
H 5.198458 -1.774323 1.136874


