%chk=000261129.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261129

0 1
O -5.544742 -0.184655 -0.543675
N 2.245293 -0.195795 0.084570
C 2.809720 1.192655 0.006766
C 3.060530 -1.151259 -0.738251
C 4.254246 1.200851 0.534002
C 4.509738 -1.178293 -0.223686
C 5.133622 0.222361 -0.254296
C 0.810958 -0.216872 -0.355220
C -0.072173 0.295787 0.800190
C -1.527170 0.147485 0.458443
C -2.198140 1.171492 -0.235836
C -2.223517 -1.014507 0.820513
C -3.544752 1.046214 -0.564674
C -3.576063 -1.166689 0.503467
C -4.215801 -0.128970 -0.186316
H 2.179039 1.850997 0.643095
H 2.780555 1.610427 -1.022584
H 3.048836 -0.904079 -1.821358
H 2.611529 -2.162130 -0.627160
H 4.253939 0.918714 1.606192
H 4.665605 2.224400 0.478387
H 5.106676 -1.882855 -0.829772
H 4.521259 -1.566919 0.814695
H 5.246788 0.567329 -1.299153
H 6.152569 0.195411 0.173459
H 0.519627 -1.263623 -0.592853
H 0.621222 0.377660 -1.273671
H 0.180753 -0.261216 1.727668
H 0.172705 1.351620 1.032177
H -1.658560 2.074824 -0.520030
H -1.707332 -1.811444 1.356304
H -4.082096 1.825879 -1.098973
H -4.110970 -2.066187 0.787451
H -5.971193 -1.025413 -0.251673


%chk=000261129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261129

0 1
O -5.628036 -0.220228 -0.642513
N 2.280671 -0.202140 0.089532
C 2.842579 1.173062 0.053510
C 3.082937 -1.128197 -0.753769
C 4.303730 1.194558 0.547798
C 4.550945 -1.182743 -0.283298
C 5.178012 0.229701 -0.284668
C 0.839834 -0.243930 -0.260129
C -0.076548 0.313291 0.863153
C -1.548513 0.170780 0.508590
C -2.220749 1.168802 -0.246739
C -2.281817 -0.984474 0.878297
C -3.571633 1.027550 -0.621657
C -3.636621 -1.145500 0.512605
C -4.279593 -0.134940 -0.241209
H 2.225312 1.828947 0.692791
H 2.801680 1.590710 -0.989905
H 3.057388 -0.817317 -1.833510
H 2.627461 -2.134253 -0.691010
H 4.323669 0.887568 1.611337
H 4.696110 2.228170 0.487876
H 5.122806 -1.866258 -0.940322
H 4.578469 -1.598345 0.742609
H 5.243328 0.601505 -1.328636
H 6.209977 0.197798 0.113063
H 0.563574 -1.301559 -0.434325
H 0.623111 0.304236 -1.214144
H 0.161907 -0.235520 1.792607
H 0.161741 1.378396 1.042391
H -1.679220 2.076745 -0.540225
H -1.790247 -1.768990 1.466692
H -4.090922 1.798566 -1.198924
H -4.186021 -2.046975 0.816248
H -6.032619 -1.065818 -0.325917


