%chk=000222127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222127

0 1
O 0.431724 0.497847 -1.816982
N -3.177151 0.530656 0.284851
C -4.415642 -0.063580 -0.328864
C -3.251723 2.031381 0.209229
C -1.936060 0.018849 -0.407648
C -5.655805 0.396876 0.455247
C -4.463945 2.532581 1.010589
C -5.765675 1.926137 0.472667
C -0.672132 0.557091 0.307503
C -1.879613 -1.501098 -0.367515
C 0.530774 0.572105 -0.607480
C -1.446948 -2.195053 -1.506712
C -2.206438 -2.212973 0.796568
C -1.355891 -3.589674 -1.484392
C -2.116189 -3.606647 0.813625
C 1.844072 0.715274 0.073403
C -1.692338 -4.297751 -0.326676
C 2.989086 0.681343 -0.623907
C 4.326427 0.815783 -0.025950
C 4.635019 0.223243 1.209473
C 5.315303 1.542255 -0.713238
C 5.915773 0.360483 1.751667
C 6.590175 1.683050 -0.161755
C 6.892954 1.091997 1.070034
H -4.341790 -1.171816 -0.274519
H -4.524446 0.198890 -1.403098
H -3.306303 2.403786 -0.836627
H -2.317732 2.447650 0.653272
H -1.902506 0.362782 -1.481126
H -5.593017 0.016399 1.494561
H -6.562165 -0.052462 0.010969
H -4.504588 3.635889 0.972714
H -4.338716 2.257011 2.077017
H -5.971733 2.305774 -0.545782
H -6.621216 2.241078 1.097680
H -0.475776 -0.040675 1.221414
H -0.848629 1.590307 0.687805
H -1.165042 -1.644491 -2.405848
H -2.542108 -1.669384 1.681396
H -1.019492 -4.123711 -2.371152
H -2.375444 -4.155622 1.716686
H 1.823216 0.851329 1.153325
H -1.622648 -5.382998 -0.311623
H 2.968572 0.555011 -1.717238
H 3.878367 -0.352796 1.740821
H 5.085140 2.001761 -1.673863
H 6.151787 -0.104168 2.708006
H 7.351504 2.252214 -0.693470
H 7.889209 1.200270 1.495643


%chk=000222127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222127

0 1
O 0.411531 1.884320 -2.003859
N -3.303845 0.729464 0.216985
C -4.306653 -0.229338 -0.334744
C -3.863420 2.108649 0.237285
C -2.000247 0.599274 -0.507882
C -5.604688 -0.234961 0.494722
C -5.157838 2.176938 1.075895
C -6.217902 1.180503 0.559818
C -0.957916 1.657608 -0.014817
C -1.416881 -0.806078 -0.309469
C 0.361604 1.531166 -0.781248
C -0.839571 -1.509978 -1.393635
C -1.390594 -1.392193 0.982122
C -0.240274 -2.775313 -1.193017
C -0.796224 -2.656596 1.184698
C 1.541937 0.997206 -0.059209
C -0.215039 -3.352409 0.096958
C 2.776840 0.952830 -0.654071
C 4.030777 0.447354 -0.085989
C 4.114235 -0.167061 1.199150
C 5.225750 0.569581 -0.854121
C 5.346858 -0.633342 1.693486
C 6.460790 0.104013 -0.358325
C 6.526637 -0.499119 0.919192
H -3.859717 -1.237928 -0.340552
H -4.552223 0.031087 -1.398534
H -4.075945 2.471517 -0.803488
H -3.123566 2.795316 0.681716
H -2.132619 0.778054 -1.605380
H -5.373855 -0.588511 1.518547
H -6.318579 -0.952694 0.046456
H -5.547076 3.213253 1.052942
H -4.908849 1.936516 2.128040
H -6.549133 1.485391 -0.454606
H -7.113199 1.192393 1.210010
H -0.813492 1.539561 1.074189
H -1.339745 2.673215 -0.219469
H -0.852806 -1.062709 -2.395065
H -1.868008 -0.854873 1.809887
H 0.204364 -3.307990 -2.041328
H -0.789293 -3.103540 2.185889
H 1.376116 0.639785 0.963787
H 0.246636 -4.334184 0.252757
H 2.824593 1.347570 -1.680747
H 3.210029 -0.287611 1.805625
H 5.174722 1.036201 -1.845538
H 5.394403 -1.105381 2.681110
H 7.367733 0.208818 -0.963627
H 7.483846 -0.863572 1.308154


