%chk=000237325.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237325

0 1
O 0.058116 -0.881797 -1.742949
O -0.127081 -0.892431 1.719187
O 2.849527 -0.428795 0.291143
O -2.919558 -0.415080 -0.302725
N 5.460127 2.977416 -0.050078
N -5.123726 3.262321 0.237490
C 0.541055 -0.287500 -0.524611
C -0.606764 -0.287976 0.504869
C 1.647700 -1.185591 0.088618
C -1.717484 -1.176685 -0.114289
C -1.236498 -1.509624 -1.535206
C 1.159533 -1.534759 1.503451
C 3.703567 -0.328397 -0.884748
C -3.758181 -0.310316 0.882681
C 4.809516 0.629048 -0.453701
C -4.782591 0.758025 0.512402
C 4.323678 2.086913 -0.430844
C -4.202562 2.178240 0.658272
H 0.917297 0.710135 -0.819319
H -0.978118 0.709827 0.805772
H 1.844905 -2.072647 -0.546466
H -1.914789 -2.070699 0.510612
H -1.893356 -1.073721 -2.311937
H -1.086436 -2.585717 -1.706981
H 1.820164 -1.119602 2.288136
H 0.995421 -2.611385 1.657545
H 4.092260 -1.335676 -1.114887
H 3.111836 0.045156 -1.737507
H -4.225250 -1.296050 1.053134
H -3.140835 -0.035322 1.754851
H 5.174543 0.335206 0.552903
H 5.681340 0.533706 -1.133161
H -5.105348 0.590173 -0.537398
H -5.686784 0.638968 1.137765
H 3.444807 2.170730 0.246903
H 3.980931 2.390832 -1.445002
H -3.268546 2.258881 0.054737
H -3.909785 2.368105 1.714616
H 5.790354 2.756603 0.884723
H 5.156122 3.946422 -0.034044
H -5.999291 3.216404 0.748732
H -5.349614 3.183857 -0.749388


%chk=000237325-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237325

0 1
O -0.510492 -1.948985 -1.535779
O 0.423456 -1.961118 1.519072
O 2.619069 -0.456423 -0.084305
O -2.730314 -0.508606 0.087781
N 4.500641 3.363366 0.767033
N -4.072830 3.543809 -0.705030
C 0.262141 -0.992739 -0.704536
C -0.371977 -1.011674 0.702954
C 1.703340 -1.527325 -0.492573
C -1.800496 -1.574720 0.480222
C -1.614471 -2.513718 -0.718736
C 1.538464 -2.489147 0.691806
C 3.115300 0.357276 -1.211659
C -3.278943 0.242202 1.233317
C 4.113957 1.374550 -0.654352
C -4.134826 1.379927 0.666291
C 3.472100 2.410849 0.290498
C -3.299791 2.440554 -0.105659
H 0.233827 -0.006199 -1.196114
H -0.369085 -0.031928 1.209106
H 2.068980 -2.032897 -1.409513
H -2.159840 -2.102185 1.386754
H -2.517552 -2.551586 -1.348884
H -1.340114 -3.531619 -0.378789
H 2.443002 -2.516636 1.320322
H 1.285717 -3.507436 0.336835
H 3.606151 -0.308598 -1.955117
H 2.270717 0.874095 -1.717802
H -3.884346 -0.444130 1.865178
H -2.455304 0.650318 1.860556
H 4.912900 0.824588 -0.117717
H 4.594034 1.913728 -1.493234
H -4.900459 0.950065 -0.008708
H -4.672783 1.871314 1.503017
H 2.938367 1.867766 1.103795
H 2.711330 2.986645 -0.272832
H -2.737642 1.931778 -0.908670
H -2.546759 2.876922 0.581407
H 5.247569 2.912844 1.307843
H 4.119241 4.174683 1.264507
H -4.591324 4.113725 -0.029020
H -4.660753 3.263865 -1.495965


