%chk=000267054.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267054

0 1
O 5.586261 -1.247510 -0.303709
O 3.173258 2.380739 1.051855
N 3.690683 -0.585250 0.873989
N 1.889720 2.353396 -0.874038
N 2.957172 -1.672985 0.478108
N 0.726303 2.452013 -0.153136
C 5.634965 1.910373 -0.324895
C 5.633791 0.890678 0.820603
C 4.299950 2.026574 -1.073948
C -0.487917 -2.830394 0.323810
C -2.861216 2.035992 -0.470261
C -1.240071 -3.974267 -0.053877
C -4.049221 2.182403 0.294079
C 0.939300 -2.963337 0.479455
C -1.650033 2.648718 0.013876
C 5.023566 -0.431236 0.384585
C 3.122083 2.279439 -0.152724
C -1.178813 -1.592513 0.523625
C -2.916178 1.274094 -1.681090
C -0.573649 -5.221020 -0.278463
C -4.019841 2.922875 1.518725
C 1.551201 -4.178127 0.246836
C -1.654035 3.348498 1.203203
C -2.659165 -3.863798 -0.209948
C -5.263043 1.580462 -0.169171
C 0.786999 -5.315409 -0.135311
C -2.850306 3.486370 1.960647
C 1.729892 -1.791339 0.908979
C -0.411746 2.535147 -0.786087
C -2.539688 -1.512413 0.365145
C -4.092182 0.704917 -2.101959
C -3.292152 -2.664083 -0.004925
C -5.284122 0.861592 -1.337320
H 6.423724 1.638596 -1.059215
H 5.917113 2.901522 0.088507
H 6.676288 0.698688 1.153871
H 5.115942 1.329093 1.704017
H 4.381898 2.836750 -1.828956
H 4.126657 1.090496 -1.655080
H -0.607849 -0.705831 0.802358
H -2.005393 1.140366 -2.263662
H -1.167778 -6.086842 -0.565907
H -4.941806 3.025861 2.089782
H 2.634746 -4.280549 0.347803
H -0.735136 3.802598 1.583029
H -3.221772 -4.751463 -0.494438
H -6.166799 1.706446 0.425990
H 1.306112 -6.257125 -0.309616
H -2.814532 4.046882 2.894542
H 1.204678 -1.089684 1.577008
H -0.556645 2.531132 -1.876890
H -3.064782 -0.567520 0.514391
H -4.132004 0.122210 -3.021566
H -4.370319 -2.570600 -0.120777
H -6.203312 0.401714 -1.696997
H 3.283325 0.146710 1.484143
H 1.878875 2.287952 -1.898293


%chk=000267054-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267054

0 1
O 5.689413 -0.714690 0.487385
O 1.114478 0.569673 0.180537
N 3.378867 -1.053824 0.839446
N 0.558817 2.223448 -1.375871
N 3.476400 -2.430253 0.951504
N -0.641582 2.534126 -0.755327
C 3.932081 1.722008 -0.909202
C 4.191468 1.234062 0.542695
C 2.712519 1.060869 -1.624467
C 1.104416 -5.295805 1.401012
C -3.495840 4.888862 -1.336593
C 1.173595 -6.740063 1.549298
C -4.755312 5.229290 -0.696329
C 2.343418 -4.550523 1.255561
C -2.665265 3.865139 -0.725587
C 4.518468 -0.266965 0.622418
C 1.402799 1.239083 -0.858811
C -0.196216 -4.684820 1.405527
C -3.148025 5.589447 -2.541410
C 2.446917 -7.395492 1.546245
C -5.146840 4.559006 0.507005
C 3.572088 -5.244298 1.256802
C -3.096099 3.234122 0.460724
C -0.037818 -7.495621 1.696210
C -5.596595 6.236223 -1.277091
C 3.625105 -6.656280 1.400810
C -4.328965 3.577311 1.075012
C 2.340866 -3.087376 1.111545
C -1.380455 3.470981 -1.318429
C -1.358251 -5.447454 1.549916
C -3.988054 6.565950 -3.083175
C -1.283025 -6.867581 1.697898
C -5.225662 6.895842 -2.448160
H 4.830354 1.514679 -1.520642
H 3.796955 2.821199 -0.891707
H 5.076375 1.765831 0.932823
H 3.330683 1.485435 1.188295
H 2.634342 1.474029 -2.648665
H 2.892738 -0.024343 -1.723827
H -0.296447 -3.600902 1.293256
H -2.210147 5.367177 -3.060043
H 2.481568 -8.485624 1.659753
H -6.100105 4.829849 0.976008
H 4.490755 -4.659782 1.145721
H -2.450967 2.466925 0.899955
H 0.035503 -8.584290 1.807238
H -6.542800 6.478583 -0.779024
H 4.596939 -7.161574 1.399127
H -4.633498 3.068485 1.995381
H 1.374509 -2.554154 1.147215
H -1.051852 3.979551 -2.244636
H -2.336653 -4.954084 1.549787
H -3.697616 7.084793 -4.003356
H -2.201469 -7.453815 1.810819
H -5.874344 7.662956 -2.883932
H 2.449760 -0.573506 0.809006
H 0.850702 2.716184 -2.234947


