%chk=000205895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205895

0 1
O -3.603127 0.108760 -1.748871
N 2.342557 0.452595 0.155124
N -2.838298 0.328371 0.424874
C 4.039582 -1.726601 -0.839914
C 2.515863 -1.735908 -1.012704
C 4.418114 -0.894335 0.391176
C 1.956412 -0.305720 -1.081618
C 3.836132 0.526198 0.299444
C 1.772098 1.847081 0.127246
C -2.376858 -0.554673 1.533643
C -2.785198 -1.984534 1.104965
C -3.382294 -1.867835 -0.307063
C -3.289292 -0.399818 -0.692433
C -2.321118 1.711119 0.315448
C 0.327911 1.797552 0.187844
C -0.876552 1.764003 0.246078
H 4.418091 -2.759765 -0.733063
H 4.523993 -1.313517 -1.744635
H 2.231887 -2.288882 -1.926265
H 2.048469 -2.271622 -0.162260
H 4.034240 -1.388833 1.306426
H 5.516087 -0.839395 0.500830
H 2.297318 0.191530 -2.014695
H 0.844656 -0.342934 -1.121972
H 4.060488 1.077332 1.238406
H 4.323098 1.080222 -0.531620
H -2.877146 -0.246716 2.474107
H -1.280197 -0.469570 1.690367
H 2.157350 2.391072 1.027842
H 2.092690 2.438646 -0.766393
H -3.518465 -2.411461 1.810356
H -1.912400 -2.659779 1.113530
H -4.434878 -2.203834 -0.346500
H -2.837200 -2.483455 -1.045627
H -2.690625 2.295368 1.196118
H -2.773587 2.176635 -0.604190


%chk=000205895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205895

0 1
O -3.761141 -0.347661 -1.800692
N 2.512663 0.332752 0.104992
N -2.892903 0.169655 0.331443
C 4.464743 -1.486550 -1.133018
C 2.973799 -1.480042 -1.542066
C 4.617404 -0.983938 0.320629
C 2.347949 -0.090679 -1.310944
C 3.945375 0.392043 0.496486
C 1.833471 1.624955 0.392507
C -2.643964 -0.475260 1.635858
C -3.612303 -1.694489 1.612270
C -3.824081 -1.989395 0.104488
C -3.519443 -0.657524 -0.599285
C -2.328624 1.474223 -0.044360
C 0.368483 1.562335 0.229531
C -0.857096 1.532319 0.091107
H 4.893543 -2.500891 -1.239656
H 5.035096 -0.820496 -1.813680
H 2.858105 -1.759981 -2.606670
H 2.419668 -2.223442 -0.937278
H 4.138443 -1.703100 1.012714
H 5.686225 -0.908741 0.599385
H 2.826071 0.651621 -2.005858
H 1.267851 -0.109567 -1.541116
H 4.005486 0.711318 1.554703
H 4.502886 1.152549 -0.115155
H -2.861070 0.221990 2.466006
H -1.582267 -0.783134 1.718755
H 2.069573 1.902427 1.439012
H 2.227004 2.455060 -0.253707
H -4.572906 -1.415685 2.079743
H -3.200221 -2.553443 2.166601
H -4.840960 -2.330702 -0.147161
H -3.115641 -2.748362 -0.278229
H -2.786620 2.274417 0.572282
H -2.634799 1.642717 -1.095636


