%chk=000277164.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277164

0 1
S 0.037887 -0.111451 1.585905
O 4.702469 0.745206 0.093320
O 4.784726 0.280972 2.279098
N 2.301586 1.973679 2.010996
C 1.844875 -0.525434 1.549019
C -0.785959 -0.113539 -0.073141
C 2.600306 0.784782 1.184516
C -0.980381 -1.505565 -0.639020
C -2.181793 0.402330 0.256035
C 0.051353 0.831884 -0.903393
C 2.169112 -1.628634 0.564965
C 2.081688 -0.957605 2.989561
C 4.108751 0.574629 1.322913
C -1.392558 -1.632575 -1.979755
C -2.859329 -0.048873 1.399643
C 0.889974 0.376995 -1.931526
C -0.863659 -2.659345 0.145916
C -2.835670 1.281802 -0.623536
C 0.036962 2.207928 -0.600808
C -1.628941 -2.890768 -2.533541
C -4.146719 0.418530 1.684309
C 1.687813 1.275350 -2.648361
C -1.101109 -3.920683 -0.413391
C -4.123847 1.739202 -0.338393
C 0.834513 3.100987 -1.316312
C -1.475811 -4.042072 -1.752632
C -4.780079 1.316828 0.822051
C 1.663043 2.637845 -2.344900
H 2.391161 1.049551 0.102954
H 1.921290 -1.367448 -0.472777
H 1.633848 -2.561340 0.793266
H 3.239875 -1.880145 0.580641
H 1.613565 -1.924865 3.214765
H 3.161400 -1.068574 3.196773
H 1.703918 -0.241862 3.732282
H -1.539794 -0.739968 -2.589014
H -2.408204 -0.778762 2.074861
H 0.939934 -0.684627 -2.179909
H -0.601014 -2.597711 1.203701
H -2.345069 1.609848 -1.540405
H -0.601160 2.582899 0.202416
H 2.293801 1.745633 3.003007
H 1.387511 2.354765 1.771130
H -1.940738 -2.975997 -3.573363
H -4.657991 0.073129 2.581760
H 2.334714 0.905669 -3.443125
H -0.999515 -4.810748 0.205849
H -4.618544 2.424684 -1.024624
H 0.817392 4.161987 -1.068558
H -1.657895 -5.023829 -2.184994
H -5.780911 1.679497 1.047302
H 2.288358 3.335524 -2.899121
H 5.692461 0.666986 0.128144


%chk=000277164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277164

0 1
S 0.045811 -0.201714 1.718733
O 4.774872 0.444050 0.207373
O 4.872073 1.016505 2.449255
N 2.262866 2.011863 2.211825
C 1.984791 -0.494262 1.629969
C -0.797735 -0.137933 -0.072939
C 2.664783 0.920422 1.323556
C -1.035361 -1.548172 -0.671993
C -2.215647 0.424211 0.237507
C 0.047666 0.800481 -0.949888
C 2.372099 -1.567211 0.600894
C 2.284494 -0.960530 3.072125
C 4.185752 0.810930 1.421587
C -1.597233 -1.636651 -1.976957
C -2.974456 -0.113694 1.311447
C 0.811119 0.335825 -2.051109
C -0.848015 -2.747266 0.053766
C -2.837782 1.374298 -0.613050
C 0.125255 2.182763 -0.621064
C -1.927388 -2.884508 -2.543686
C -4.297365 0.313185 1.550694
C 1.615944 1.221472 -2.804434
C -1.181835 -4.000434 -0.510304
C -4.167418 1.792928 -0.381821
C 0.924122 3.068231 -1.370414
C -1.717902 -4.078274 -1.813676
C -4.903021 1.270974 0.704797
C 1.675954 2.591863 -2.471378
H 2.421776 1.171476 0.278239
H 2.151331 -1.246860 -0.429173
H 1.840150 -2.512510 0.795009
H 3.458440 -1.766494 0.659746
H 1.788321 -1.923722 3.280041
H 3.374437 -1.091453 3.206141
H 1.942068 -0.224083 3.820831
H -1.793434 -0.721790 -2.546922
H -2.529564 -0.874621 1.961570
H 0.778538 -0.722140 -2.329011
H -0.456002 -2.692004 1.074627
H -2.286678 1.791977 -1.461208
H -0.430594 2.558174 0.244954
H 2.791317 2.054262 3.088562
H 1.246714 2.084234 2.319778
H -2.357676 -2.924283 -3.550866
H -4.858419 -0.109105 2.391976
H 2.202049 0.833471 -3.644967
H -1.026716 -4.913859 0.075349
H -4.626171 2.527026 -1.054012
H 0.974616 4.124240 -1.084525
H -1.978253 -5.048629 -2.250875
H -5.932618 1.599008 0.886044
H 2.305049 3.276618 -3.050540
H 5.762471 0.388414 0.330918


