%chk=000211983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211983

0 1
O 0.280249 3.065133 -0.029244
O 2.148882 0.853791 -0.231218
N -1.967194 0.168436 -0.113692
C -2.320187 -0.262882 -1.515736
C -2.862252 -0.316583 0.994233
C -3.785853 -0.770252 -1.614112
C -3.308019 -1.767115 0.676417
C -4.117671 -1.884841 -0.618505
C -1.518573 1.573577 0.065451
C -1.329131 -1.392133 -1.875082
C -2.168488 0.862605 -2.563763
C -4.092200 0.589798 1.222694
C -2.023455 -0.353800 2.295118
C -0.030672 1.691388 -0.335687
C 0.872848 0.752953 0.474065
C 3.210309 0.111756 0.233794
C 3.175489 -0.746971 1.338803
C 4.382156 0.299583 -0.529792
C 4.348232 -1.430476 1.682127
C 5.529979 -0.394105 -0.162634
C 5.519153 -1.259888 0.942258
H -3.985260 -1.118419 -2.643630
H -4.470014 0.086635 -1.445787
H -3.891508 -2.166199 1.525234
H -2.403287 -2.405115 0.602857
H -5.201059 -1.862240 -0.392476
H -3.927317 -2.873115 -1.079944
H -2.108276 2.317577 -0.513625
H -1.618159 1.888686 1.130607
H -1.529341 -1.798772 -2.869124
H -0.295071 -1.030749 -1.857349
H -1.388015 -2.216685 -1.155596
H -1.133002 1.226861 -2.623982
H -2.430128 0.500915 -3.563657
H -2.810642 1.722198 -2.348108
H -3.811789 1.580884 1.589599
H -4.660572 0.732183 0.295799
H -4.773410 0.152663 1.958414
H -1.130992 -0.976065 2.171557
H -1.683660 0.645699 2.589245
H -2.605742 -0.759039 3.127297
H 0.124356 1.535916 -1.431264
H 0.515841 -0.293029 0.435553
H 1.009827 1.089941 1.513529
H 1.239749 3.224580 -0.159968
H 2.273377 -0.890388 1.921853
H 4.365611 0.973628 -1.381537
H 4.340623 -2.103356 2.539634
H 6.446632 -0.264432 -0.738101
H 6.423228 -1.795340 1.218375


%chk=000211983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211983

0 1
O 0.461613 2.984849 -0.333528
O 2.302740 0.852329 -0.253235
N -2.099546 0.233504 -0.247784
C -2.556977 -0.200472 -1.624973
C -2.788441 -0.317836 0.973451
C -4.004806 -0.778335 -1.571275
C -3.247284 -1.771981 0.670683
C -4.213135 -1.906904 -0.532676
C -1.443784 1.544943 -0.103077
C -1.580578 -1.276877 -2.194535
C -2.609320 0.983191 -2.632953
C -3.997530 0.558264 1.438721
C -1.788415 -0.418049 2.163240
C 0.046986 1.584857 -0.522720
C 0.942258 0.653432 0.292931
C 3.363773 0.138157 0.330244
C 3.214042 -0.766807 1.410329
C 4.641076 0.373066 -0.236823
C 4.355793 -1.431653 1.916387
C 5.767479 -0.297345 0.279083
C 5.633229 -1.204352 1.359579
H -4.267371 -1.144121 -2.582703
H -4.693557 0.061633 -1.359439
H -3.718649 -2.184752 1.582960
H -2.334926 -2.372144 0.488492
H -5.264025 -1.888312 -0.186998
H -4.062020 -2.896234 -1.004389
H -1.940994 2.352924 -0.676150
H -1.486141 1.865855 0.951877
H -1.889948 -1.598671 -3.208262
H -0.555782 -0.868928 -2.261463
H -1.544105 -2.167859 -1.544566
H -1.623807 1.449795 -2.803258
H -2.963685 0.600309 -3.607183
H -3.315013 1.767007 -2.302957
H -3.673875 1.599281 1.624836
H -4.800555 0.584601 0.683584
H -4.426251 0.167365 2.381291
H -0.903999 -1.011950 1.871679
H -1.446820 0.569420 2.520834
H -2.278119 -0.922429 3.016702
H 0.157086 1.308693 -1.593117
H 0.624924 -0.398907 0.169947
H 0.929969 0.934363 1.365137
H 1.441382 3.023109 -0.487387
H 2.233587 -0.958125 1.856249
H 4.726463 1.074477 -1.072805
H 4.239009 -2.130957 2.752146
H 6.752736 -0.112357 -0.163375
H 6.510917 -1.723669 1.758148


