%chk=000271868.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271868

0 1
O -3.035486 1.465574 -0.883846
N -1.587762 0.219342 0.441492
N -3.171491 1.659771 1.416062
C 1.537047 0.039782 0.101198
C -0.893818 -0.414610 -0.698716
C -0.698178 -1.941115 -0.471537
C 0.464165 0.278986 -0.995426
C 1.698875 -1.487098 0.339559
C 0.354505 -2.194073 0.636636
C 2.895599 0.730172 -0.248108
C -2.027130 -2.674945 -0.199972
C 2.735974 2.253438 -0.485454
C 3.970653 0.493977 0.842995
C -2.617696 1.130319 0.249298
H 1.174283 0.501123 1.049852
H -1.563756 -0.254415 -1.563418
H -0.272096 -2.331403 -1.421025
H 0.269269 1.357275 -1.130651
H 0.850915 -0.107570 -1.962528
H 2.399190 -1.676323 1.174153
H 2.152478 -1.939744 -0.568333
H 0.518916 -3.283987 0.748110
H -0.040184 -1.848176 1.617985
H 3.263208 0.273985 -1.194334
H -2.757037 -2.491443 -1.009869
H -1.867369 -3.766695 -0.121819
H -2.487369 -2.328396 0.743809
H -1.245821 0.025931 1.383207
H 3.721013 2.720970 -0.670402
H 2.292659 2.744644 0.403000
H 2.092848 2.479628 -1.353215
H 3.618109 0.862483 1.826627
H 4.234611 -0.572313 0.952774
H 4.899328 1.040720 0.595064
H -2.898906 1.378126 2.355112
H -3.927945 2.328258 1.297319


%chk=000271868-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271868

0 1
O -3.512383 0.795505 -0.789242
N -1.541817 0.347084 0.404479
N -3.327488 1.494744 1.426118
C 1.578574 0.057051 0.103017
C -0.861157 -0.332012 -0.717415
C -0.709333 -1.865309 -0.481595
C 0.517247 0.320951 -1.001851
C 1.692499 -1.472444 0.349637
C 0.324973 -2.136894 0.637379
C 2.957332 0.707210 -0.246635
C -2.062701 -2.549972 -0.205790
C 2.845975 2.236972 -0.468966
C 4.030242 0.424984 0.835346
C -2.827614 0.868968 0.278287
H 1.233372 0.533857 1.052295
H -1.526012 -0.171153 -1.586009
H -0.293408 -2.276273 -1.427836
H 0.361331 1.404584 -1.149058
H 0.903266 -0.087699 -1.959547
H 2.379902 -1.676171 1.191454
H 2.142057 -1.941493 -0.552004
H 0.458020 -3.229522 0.763133
H -0.076802 -1.764693 1.604908
H 3.303709 0.247695 -1.199096
H -2.789226 -2.341388 -1.011771
H -1.941400 -3.646174 -0.120015
H -2.503473 -2.180037 0.738585
H -1.032480 0.452436 1.282171
H 3.843531 2.673298 -0.662302
H 2.431191 2.734780 0.429728
H 2.200538 2.492622 -1.326862
H 3.696764 0.795112 1.825038
H 4.258319 -0.650601 0.932994
H 4.975238 0.942596 0.586516
H -2.814317 1.577193 2.300848
H -4.262868 1.886393 1.359659


