%chk=000297095.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297095

0 1
O 0.831784 -0.534514 1.109331
O 3.306993 2.786947 -0.947567
N -2.416777 -0.479052 -0.634009
N 2.298362 1.061122 0.296164
N 3.386942 0.788493 1.157371
C 0.112137 1.022231 -0.714159
C -0.269059 -0.020336 -1.779964
C -1.154161 1.568059 -0.032711
C 0.970652 2.164929 -1.318755
C -1.181566 -1.115297 -1.203143
C -2.050111 0.436866 0.496661
C 1.038300 0.369832 0.338155
C 2.348367 2.114191 -0.682858
C -3.374016 -1.540447 -0.170646
C -4.701723 -0.929114 0.210942
C 4.343787 -0.153827 0.580759
C -5.309178 -1.276966 1.426080
C -5.347018 -0.036321 -0.658668
C 4.493958 -1.446400 1.110288
C 5.186368 0.303489 -0.445702
C -6.554858 -0.739114 1.763782
C -6.589331 0.500590 -0.314619
C -7.196827 0.149032 0.895911
C 5.505115 -2.273869 0.615906
C 6.186686 -0.538783 -0.933710
C 6.348643 -1.824617 -0.405466
H 0.632863 -0.481880 -2.223526
H -0.801090 0.493123 -2.608877
H -1.728473 2.167405 -0.770785
H -0.894772 2.254534 0.794745
H 0.519414 3.163071 -1.147854
H 1.061171 2.086062 -2.420129
H -1.488110 -1.804622 -2.019025
H -0.620479 -1.719098 -0.452695
H -1.539121 -0.093444 1.332955
H -2.988999 0.870611 0.907906
H -2.965772 -2.154356 0.663357
H -3.544217 -2.242464 -1.021761
H 3.005919 0.423674 2.056404
H -4.816564 -1.965074 2.109669
H -4.863842 0.240853 -1.596462
H 3.831418 -1.805429 1.896028
H 5.063264 1.318718 -0.837356
H -7.024656 -1.013428 2.706664
H -7.086645 1.193609 -0.990911
H -8.165880 0.566060 1.160669
H 5.632593 -3.274705 1.026251
H 6.847437 -0.188809 -1.726145
H 7.132670 -2.474839 -0.788694


%chk=000297095-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297095

0 1
O 0.921731 -0.577180 1.262400
O 3.350386 2.873565 -0.779528
N -2.440073 -0.472904 -0.502921
N 2.385372 0.999417 0.319007
N 3.494218 0.599920 1.075539
C 0.128137 1.047525 -0.508452
C -0.292584 0.043136 -1.632446
C -1.158462 1.528096 0.229634
C 0.949812 2.238203 -1.090579
C -1.231172 -1.068149 -1.125176
C -2.079622 0.372926 0.664483
C 1.115681 0.361924 0.451600
C 2.372228 2.137367 -0.540359
C -3.462152 -1.493037 -0.163100
C -4.834350 -0.887789 0.121308
C 4.491291 -0.239469 0.497201
C -5.655170 -1.408706 1.151193
C -5.327225 0.178227 -0.673737
C 5.306430 -1.005746 1.372056
C 4.723686 -0.284025 -0.900580
C -6.948231 -0.882683 1.379692
C -6.615860 0.708325 -0.445988
C -7.433265 0.177822 0.580704
C 6.339553 -1.809310 0.849573
C 5.757149 -1.099882 -1.409586
C 6.571232 -1.866746 -0.545234
H 0.605018 -0.404486 -2.102102
H -0.826516 0.627035 -2.407232
H -1.717213 2.177731 -0.472226
H -0.886074 2.140836 1.110836
H 0.532396 3.216011 -0.789535
H 0.985218 2.229615 -2.194124
H -1.550396 -1.688159 -1.984390
H -0.681801 -1.731957 -0.414921
H -1.581950 -0.228973 1.461400
H -3.009244 0.793133 1.088268
H -3.151580 -2.126531 0.706024
H -3.540875 -2.173570 -1.035380
H 3.232576 0.388347 2.044069
H -5.280681 -2.227220 1.779105
H -4.678391 0.587242 -1.456451
H 5.128790 -0.973187 2.454285
H 4.129216 0.331418 -1.581192
H -7.571668 -1.295264 2.181182
H -6.985046 1.532750 -1.067138
H -8.433762 0.588552 0.757846
H 6.960597 -2.397265 1.534610
H 5.931659 -1.126058 -2.491170
H 7.372588 -2.494127 -0.948665


