%chk=000242538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242538

0 1
N 0.059990 1.240565 -0.070772
N 1.165061 -0.879967 -0.093813
N 3.620504 -0.994654 -0.196501
N 2.471550 2.624122 -0.114487
N 4.949632 0.941444 -0.149733
N 2.291651 -2.951899 -0.214760
C -3.053623 -0.850020 -0.408260
C -1.292545 0.772070 -0.001775
C -4.008290 0.051460 0.111699
C -1.702390 -0.485704 -0.465990
C -2.240900 1.678061 0.517383
C -3.583310 1.307673 0.566932
C 1.227691 0.494394 -0.112380
C -3.468203 -2.197824 -0.907092
C 2.492215 1.180852 -0.163840
C -5.456315 -0.314053 0.182591
C 3.660656 0.380480 -0.196630
C 2.362412 -1.565631 -0.145553
H -0.969241 -1.189310 -0.868822
H 0.189495 2.263153 -0.002658
H -1.937352 2.655007 0.884258
H -4.312133 2.010290 0.970356
H -2.621191 -2.785714 -1.284954
H -3.940913 -2.787822 -0.109229
H -4.194281 -2.112248 -1.727779
H -5.610853 -1.205720 0.806512
H -6.072873 0.487530 0.608379
H -5.859974 -0.536392 -0.815233
H 3.024297 2.955318 0.674581
H 2.870818 3.014673 -0.964138
H 5.719553 0.289090 -0.272618
H 5.090983 1.814005 -0.634165
H 1.417988 -3.397477 0.025889
H 3.133989 -3.481653 -0.043399


%chk=000242538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242538

0 1
N 0.111650 1.102502 0.028415
N 1.252465 -0.979413 -0.347918
N 3.708982 -0.987927 -0.429760
N 2.459643 2.533823 0.186492
N 4.944072 0.977785 -0.148006
N 2.464771 -2.942840 -0.708400
C -3.089766 -0.905815 -0.175837
C -1.252113 0.728631 0.012419
C -4.054546 0.130583 0.011351
C -1.708267 -0.603767 -0.174574
C -2.211490 1.761069 0.198944
C -3.585835 1.454382 0.196695
C 1.276734 0.372088 -0.128909
C -3.537939 -2.343511 -0.378959
C 2.503831 1.114332 -0.047403
C -5.543410 -0.168728 0.012829
C 3.704942 0.367950 -0.207679
C 2.477960 -1.581359 -0.486060
H -0.962205 -1.387746 -0.317767
H 0.329482 2.097407 0.181613
H -1.880123 2.797456 0.344591
H -4.313588 2.262354 0.341786
H -2.672784 -3.016481 -0.502408
H -4.133296 -2.710060 0.480196
H -4.179714 -2.447395 -1.275882
H -5.818469 -0.883724 0.813182
H -6.133371 0.751379 0.167648
H -5.872918 -0.622855 -0.942520
H 2.735997 2.879060 1.108938
H 2.686966 3.158639 -0.590894
H 5.771403 0.398695 -0.267008
H 5.023809 1.977558 0.011550
H 1.573969 -3.427025 -0.763477
H 3.347257 -3.432947 -0.819192


