%chk=000222747.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222747

0 1
O 0.385713 -1.050460 1.410388
N -2.423197 0.695815 -0.001729
N 1.295907 -2.566785 -0.153608
C -2.355414 2.103429 -0.516656
C -3.783722 0.380515 0.546451
C -3.390041 2.295735 -1.637492
C -4.839098 0.551356 -0.559435
C -4.804879 1.968948 -1.143673
C -1.357385 0.447692 1.017948
C -0.205484 -0.279468 0.288351
C 0.840317 0.654381 -0.264570
C 0.864963 0.922394 -1.640745
C 1.775925 1.264949 0.582565
C 1.151117 -2.139204 1.132888
C 1.814449 1.805969 -2.161712
C 2.726351 2.143494 0.056547
C 2.744599 2.417712 -1.315034
C 1.741317 -2.771082 2.255781
C 2.519529 -3.895244 2.010911
C 2.067299 -3.671862 -0.351612
C 2.692297 -4.358685 0.695929
H -1.331258 2.267859 -0.920220
H -2.516545 2.860310 0.280659
H -4.049821 1.008442 1.423364
H -3.774688 -0.677789 0.887817
H -3.132793 1.636974 -2.491223
H -3.339899 3.332661 -2.015345
H -5.841131 0.321687 -0.155003
H -4.647689 -0.186762 -1.364538
H -5.122193 2.704317 -0.380671
H -5.528494 2.055955 -1.974913
H -0.987658 1.366780 1.517458
H -1.717480 -0.214570 1.838478
H -0.588795 -0.997476 -0.474150
H 0.147048 0.437527 -2.302819
H 1.763369 1.037088 1.648537
H 1.832898 2.012598 -3.230127
H 3.454597 2.612703 0.715131
H 3.484718 3.102569 -1.723556
H 1.578414 -2.374502 3.252137
H 2.998316 -4.419317 2.838905
H 2.169998 -3.994741 -1.394530
H 3.300920 -5.234413 0.495918


%chk=000222747-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222747

0 1
O 0.496741 -1.091699 1.577578
N -2.391517 0.775857 0.108539
N 1.292156 -2.714406 0.035788
C -2.322807 2.249379 -0.046119
C -3.784874 0.285150 0.231401
C -3.117152 2.711786 -1.284468
C -4.617721 0.686550 -1.003871
C -4.580845 2.217784 -1.214977
C -1.457565 0.229051 1.117137
C -0.234602 -0.441616 0.439989
C 0.684071 0.523617 -0.291379
C 0.627458 0.626817 -1.701814
C 1.571156 1.364205 0.428100
C 1.278408 -2.204702 1.291845
C 1.434747 1.563969 -2.385467
C 2.385162 2.295069 -0.253684
C 2.316398 2.401364 -1.663213
C 2.015438 -2.757720 2.374515
C 2.799945 -3.896122 2.118763
C 2.060901 -3.821031 -0.190844
C 2.830332 -4.446965 0.810117
H -1.262723 2.541260 -0.145765
H -2.728762 2.767488 0.864187
H -4.283688 0.691424 1.151971
H -3.761470 -0.816192 0.328276
H -2.628860 2.301462 -2.189505
H -3.079449 3.816163 -1.353944
H -5.659564 0.333712 -0.876075
H -4.196539 0.180122 -1.894138
H -5.096826 2.716608 -0.367919
H -5.128934 2.495474 -2.135336
H -1.104948 1.011260 1.823727
H -1.961483 -0.547933 1.723069
H -0.586058 -1.226674 -0.250687
H -0.050513 -0.028579 -2.259703
H 1.631658 1.271307 1.518560
H 1.382737 1.635451 -3.477928
H 3.073262 2.935574 0.310151
H 2.947824 3.124254 -2.192427
H 1.956883 -2.295380 3.363141
H 3.382901 -4.351089 2.926683
H 2.049418 -4.204638 -1.217447
H 3.431700 -5.329909 0.575976


