%chk=000264978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264978

0 1
N 4.161146 -3.042395 0.015870
N -4.166310 3.035054 -0.008587
C 0.528673 0.009480 0.556334
C -0.533934 -0.016432 -0.550715
C 1.932200 0.214818 -0.026907
C -1.937413 -0.222189 0.032494
C 2.997892 0.241217 1.081081
C -3.003169 -0.248027 -1.075445
C 4.367987 0.445764 0.499365
C -4.373231 -0.452855 -0.493747
C 5.115167 -0.636054 -0.014235
C -5.120372 0.628716 0.020433
C 4.926819 1.733088 0.450260
C -4.932069 -1.740198 -0.445246
C 6.395906 -0.426550 -0.557663
C -6.401075 0.418950 0.563843
C 6.197073 1.937506 -0.090003
C -6.202290 -1.944875 0.094996
C 6.934432 0.858689 -0.593686
C -6.939607 -0.866304 0.599266
C 4.585506 -1.966210 0.004569
C -4.590711 1.958880 0.002235
H 0.297345 0.814559 1.280782
H 0.494708 -0.936050 1.132675
H -0.302456 -0.821315 -1.275332
H -0.500157 0.929227 -1.126855
H 1.970450 1.158545 -0.605483
H 2.163807 -0.593657 -0.749108
H -1.975560 -1.166254 0.610529
H -2.169032 0.585850 0.755178
H 2.760731 1.040840 1.812997
H 2.958385 -0.702233 1.666399
H -2.963694 0.695712 -1.660297
H -2.766055 -1.047288 -1.807769
H 4.360284 2.580434 0.836369
H -4.365565 -2.587357 -0.831811
H 6.962959 -1.272278 -0.949327
H -6.968098 1.264488 0.955964
H 6.618180 2.942946 -0.120554
H -6.623406 -2.950326 0.125067
H 7.925843 1.023385 -1.013000
H -7.930992 -1.031200 1.018563


%chk=000264978-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264978

0 1
N 4.209698 -3.075201 0.048837
N -4.214677 3.067920 -0.042421
C 0.543733 0.010608 0.548738
C -0.548966 -0.017954 -0.543171
C 1.959790 0.234224 -0.025707
C -1.965013 -0.241609 0.031283
C 3.051468 0.255350 1.082694
C -3.056746 -0.262431 -1.077069
C 4.447650 0.459436 0.521152
C -4.452907 -0.466571 -0.515494
C 5.205677 -0.632974 -0.008598
C -5.210840 0.625757 0.014559
C 5.029317 1.749343 0.467865
C -5.034642 -1.756459 -0.462471
C 6.496910 -0.424181 -0.568709
C -6.502049 0.416905 0.574705
C 6.310038 1.960581 -0.088963
C -6.315339 -1.967756 0.094390
C 7.047531 0.871219 -0.609593
C -7.052737 -0.878475 0.615324
C 4.666392 -1.969191 0.022557
C -4.671485 1.961953 -0.016320
H 0.310150 0.812045 1.280254
H 0.526197 -0.944898 1.112787
H -0.315375 -0.819363 -1.274715
H -0.531449 0.937572 -1.107186
H 1.990854 1.189911 -0.586678
H 2.194271 -0.569059 -0.751897
H -1.996112 -1.197409 0.592059
H -2.199413 0.561539 0.757650
H 2.817468 1.066340 1.798451
H 2.999004 -0.698770 1.642175
H -3.004262 0.691816 -1.636332
H -2.822831 -1.073267 -1.793027
H 4.465845 2.598029 0.872726
H -4.471244 -2.605081 -0.867567
H 7.054524 -1.279958 -0.962333
H -7.059591 1.272620 0.968566
H 6.734155 2.970294 -0.114320
H -6.739510 -2.977452 0.119540
H 8.041812 1.030722 -1.039180
H -8.046999 -1.038023 1.044939


