%chk=000236466.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236466

0 1
O 3.940071 0.813577 1.700606
O -3.923155 0.546154 1.168078
N 0.201700 -1.063143 -0.217462
N 3.003587 -0.894770 0.525016
N -3.562589 -1.021187 -0.444927
C 0.605490 -0.436385 1.085766
C 1.253062 -0.817961 -1.259616
C 1.942017 -1.041316 1.560525
C 2.581058 -1.448884 -0.784989
C -1.130002 -0.546740 -0.670210
C -2.217729 -1.358364 0.070853
C 3.902694 0.188190 0.646473
C 4.840276 0.443065 -0.474701
C -4.335162 -0.027162 0.168038
C 5.701954 1.467354 -0.407009
C -5.650108 0.238053 -0.467135
C 6.683620 1.798504 -1.472610
C -6.464557 1.169516 0.048819
C -7.799344 1.507043 -0.509799
H -0.185328 -0.656860 1.836336
H 0.690095 0.670886 1.028400
H 1.401737 0.259616 -1.484740
H 0.930644 -1.310874 -2.201566
H 1.823719 -2.126776 1.774193
H 2.272779 -0.544027 2.503348
H 3.374201 -1.299385 -1.549103
H 2.449666 -2.550044 -0.658718
H -1.235841 -0.692534 -1.765525
H -1.275071 0.539458 -0.482262
H -2.037879 -2.449065 -0.049980
H -2.179058 -1.138931 1.165813
H -3.849615 -1.467908 -1.305178
H 4.802275 -0.237749 -1.323709
H 5.718437 2.126830 0.472515
H -5.915714 -0.347742 -1.342762
H 7.714051 1.738849 -1.087520
H 6.539365 2.826607 -1.838660
H 6.626824 1.132204 -2.343820
H -6.166219 1.741492 0.939237
H -7.853293 2.570792 -0.789460
H -8.061826 0.923897 -1.402951
H -8.592633 1.333017 0.234396


%chk=000236466-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236466

0 1
O 4.239453 0.811192 1.753147
O -4.040465 0.631473 1.176210
N 0.108722 -0.792466 -0.347365
N 2.895164 -0.428910 0.316635
N -3.688007 -1.073584 -0.370155
C 0.504631 -0.104852 0.911955
C 1.111437 -0.531567 -1.406811
C 1.882931 -0.602317 1.382508
C 2.500351 -1.044543 -0.964796
C -1.280650 -0.498329 -0.768076
C -2.304758 -1.319316 0.057227
C 4.067847 0.280371 0.602996
C 5.114515 0.386891 -0.461903
C -4.476969 -0.089846 0.221632
C 6.243014 1.114841 -0.236708
C -5.853302 0.030234 -0.348803
C 7.378729 1.287655 -1.210605
C -6.734012 0.949390 0.131056
C -8.141017 1.159628 -0.361650
H -0.241140 -0.318642 1.697005
H 0.540492 1.004171 0.772045
H 1.190945 0.558708 -1.651189
H 0.808916 -1.067681 -2.325837
H 1.811407 -1.678023 1.640955
H 2.229886 -0.038480 2.262896
H 3.235540 -0.821229 -1.751090
H 2.442082 -2.145478 -0.839896
H -1.382084 -0.774593 -1.835601
H -1.536249 0.584624 -0.679617
H -2.066992 -2.393733 -0.038328
H -2.243063 -1.039077 1.122445
H -4.069360 -1.614968 -1.147232
H 4.993741 -0.134422 -1.417708
H 6.323870 1.611003 0.741805
H -6.140763 -0.645252 -1.167942
H 8.329149 0.925866 -0.771320
H 7.533334 2.358973 -1.446395
H 7.205002 0.745539 -2.156587
H -6.376712 1.589628 0.951912
H -8.278463 2.198103 -0.721619
H -8.404044 0.469690 -1.182066
H -8.868908 1.016625 0.460866


