%chk=000225719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225719

0 1
N -5.623689 0.971001 0.337842
N -1.003459 -1.312480 -1.223609
N 0.774660 -1.323559 0.377635
N 0.958988 -0.141588 -1.773577
C -3.325826 -1.934367 -0.675381
C -3.750708 -0.595457 -0.064727
C -1.838040 -2.243971 -0.409970
C -5.222667 -0.281025 -0.384911
C -7.114697 1.059029 0.488550
C -5.073845 2.189012 -0.347983
C -1.502560 -3.695375 -0.774199
C 0.269030 -0.934663 -0.856382
C -7.591526 0.080319 1.563285
C -5.069749 3.374917 0.617929
C 2.767043 -0.051741 -0.163777
C 2.013452 -0.871344 0.708796
C 2.193302 0.290774 -1.413581
C 4.106001 0.428799 0.212427
C 2.540568 -1.287714 2.040291
C 2.920015 1.142715 -2.398528
C 4.250118 1.645813 0.898650
C 5.243581 -0.327810 -0.113499
C 5.522926 2.098541 1.253968
C 6.512602 0.132525 0.245708
C 6.655448 1.344588 0.929082
H -3.939265 -2.752056 -0.246159
H -3.539896 -1.949100 -1.761121
H -3.097174 0.222725 -0.429403
H -3.609006 -0.607008 1.035645
H -1.600386 -2.072379 0.677422
H -5.862594 -1.117415 -0.025424
H -5.375994 -0.216715 -1.482728
H -7.656501 0.877023 -0.464249
H -7.369923 2.095858 0.805577
H -4.025108 1.971058 -0.656346
H -5.628262 2.450038 -1.274697
H -2.080602 -4.400855 -0.168033
H -0.439881 -3.904941 -0.584496
H -1.697514 -3.920568 -1.827234
H -1.319955 -1.078672 -2.163373
H -8.645933 0.244000 1.805193
H -7.008209 0.204249 2.486507
H -7.473237 -0.963103 1.250972
H -4.523072 4.223903 0.196199
H -4.588931 3.100384 1.567398
H -6.083698 3.711245 0.861093
H 2.749933 -0.410750 2.672116
H 3.485179 -1.842829 1.935588
H 1.833191 -1.930822 2.587733
H 3.877148 0.682749 -2.688119
H 2.336773 1.308102 -3.318440
H 3.152649 2.129469 -1.969533
H 3.368220 2.231040 1.150635
H 5.130892 -1.270289 -0.644980
H 5.633156 3.042074 1.785924
H 7.393542 -0.454948 -0.007535
H 7.644790 1.699993 1.207230


%chk=000225719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225719

0 1
N -5.675075 0.967902 0.259590
N -0.986426 -1.305286 -1.219067
N 0.808264 -1.423850 0.308905
N 0.894182 -0.001135 -1.681143
C -3.306117 -1.973626 -0.696524
C -3.750348 -0.632480 -0.071652
C -1.806128 -2.293345 -0.489095
C -5.245418 -0.334705 -0.314276
C -7.113091 0.985702 0.641348
C -5.297235 2.119946 -0.604029
C -1.452302 -3.737595 -0.920129
C 0.275310 -0.907058 -0.845746
C -7.396133 0.214621 1.945058
C -5.154887 3.439381 0.179240
C 2.775150 -0.033444 -0.119048
C 2.050838 -0.982218 0.668224
C 2.134028 0.429335 -1.316019
C 4.133289 0.448368 0.278678
C 2.598806 -1.559889 1.956152
C 2.793397 1.410371 -2.262178
C 4.348680 1.807593 0.636299
C 5.244544 -0.437928 0.308792
C 5.630771 2.265859 1.012661
C 6.528161 0.017825 0.683202
C 6.727206 1.372672 1.037125
H -3.895550 -2.802177 -0.255756
H -3.532965 -1.981711 -1.785647
H -3.126211 0.187438 -0.476921
H -3.570863 -0.646423 1.020382
H -1.548071 -2.179541 0.580240
H -5.842319 -1.136048 0.161063
H -5.465115 -0.391331 -1.413085
H -7.760837 0.588937 -0.182825
H -7.409230 2.040217 0.788948
H -4.323244 1.885914 -1.071561
H -6.026483 2.253900 -1.444526
H -2.023122 -4.473241 -0.323297
H -0.376222 -3.925515 -0.763270
H -1.686947 -3.901626 -1.988714
H -1.317681 -0.932358 -2.110974
H -8.469074 0.276677 2.207591
H -6.801806 0.640783 2.771858
H -7.135034 -0.855662 1.856663
H -4.843919 4.258520 -0.496179
H -4.396791 3.326189 0.973446
H -6.104488 3.742877 0.656604
H 3.205494 -0.823529 2.509048
H 3.248848 -2.432002 1.751859
H 1.762042 -1.906314 2.582920
H 3.875100 1.216871 -2.360622
H 2.307275 1.343861 -3.247959
H 2.681985 2.449097 -1.897929
H 3.500613 2.502490 0.631863
H 5.099579 -1.486767 0.024206
H 5.772929 3.316583 1.290158
H 7.371644 -0.681924 0.695153
H 7.722298 1.727199 1.328297


