%chk=000250257.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250257

0 1
O 0.530918 -2.782099 -0.702284
O -4.795133 -1.227121 1.862713
O 2.826769 -0.941643 0.040053
O 4.399242 0.520383 0.747898
N -2.402974 -0.805192 -0.913829
N 0.674783 3.732442 0.269228
C 0.441225 1.572222 -0.470696
C -1.625726 0.329352 -0.523784
C -0.261982 2.698270 0.068947
C 1.824492 1.961683 -0.592894
C -0.250404 0.382861 -0.755260
C -1.691121 -2.031758 -1.352557
C -3.662820 -1.067510 -0.176268
C -2.311254 1.473591 0.014578
C -1.648950 2.645791 0.309753
C 1.935401 3.271639 -0.132685
C 2.915276 1.107279 -1.116346
C -0.836413 -2.742076 -0.283543
C -3.475661 -1.413209 1.312421
C 3.492745 0.261262 -0.006648
C 3.254664 -1.934993 1.036025
C 3.475746 -3.221361 0.271763
H 0.314478 -0.460630 -1.153040
H -1.037900 -1.764254 -2.220212
H -2.445199 -2.735828 -1.769676
H -4.222779 -1.880763 -0.688773
H -4.321898 -0.165861 -0.252842
H -3.388792 1.414104 0.177842
H -2.176345 3.505849 0.713797
H 0.471041 4.638414 0.639912
H 2.816006 3.888552 -0.063700
H 2.536594 0.458662 -1.940203
H 3.733040 1.720785 -1.557373
H -0.905932 -2.263204 0.707464
H -1.096279 -3.813625 -0.196346
H -3.166398 -2.459624 1.470902
H -2.769904 -0.728320 1.815845
H 0.957135 -1.883448 -0.599167
H -4.779978 -1.372944 2.827556
H 4.162269 -1.572291 1.553992
H 2.405703 -1.984650 1.739135
H 3.772267 -4.037355 0.940451
H 2.556344 -3.540022 -0.252167
H 4.254103 -3.111364 -0.493382


%chk=000250257-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250257

0 1
O 0.627640 -2.904751 -0.611679
O -5.474448 -1.406058 1.424136
O 2.813739 -1.016375 -0.047330
O 4.609575 0.427636 0.343799
N -2.404337 -0.833979 -0.640846
N 0.780544 3.716336 0.319311
C 0.440116 1.598371 -0.466543
C -1.668967 0.344912 -0.381780
C -0.195666 2.716927 0.165523
C 1.828709 1.955298 -0.690051
C -0.298665 0.426537 -0.748098
C -1.698443 -2.031298 -1.128749
C -3.815233 -0.961197 -0.256340
C -2.279482 1.486859 0.254482
C -1.559955 2.666808 0.520702
C 1.996834 3.251825 -0.196229
C 2.884215 1.063549 -1.308010
C -0.723979 -2.684342 -0.084383
C -4.017845 -1.356560 1.222014
C 3.551789 0.164415 -0.267297
C 3.365495 -1.987138 0.965017
C 3.955992 -3.197488 0.241071
H 0.198789 -0.401494 -1.256123
H -1.111936 -1.800039 -2.040296
H -2.468348 -2.761632 -1.432672
H -4.294907 -1.730419 -0.887877
H -4.359065 -0.018883 -0.447549
H -3.333452 1.452478 0.544657
H -2.063230 3.513662 1.000856
H 0.628415 4.634809 0.728683
H 2.893853 3.868011 -0.169794
H 2.434252 0.432140 -2.094779
H 3.687643 1.667133 -1.762421
H -0.701825 -2.052882 0.827141
H -1.081502 -3.690364 0.193656
H -3.552002 -2.346657 1.416920
H -3.543738 -0.604432 1.886414
H 1.169706 -2.070730 -0.555972
H -5.674577 -1.651436 2.361518
H 4.115522 -1.451692 1.570555
H 2.495956 -2.263368 1.583048
H 4.325388 -3.926996 0.986051
H 3.188309 -3.694315 -0.376014
H 4.805520 -2.901187 -0.398121


