%chk=000299667.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299667

0 1
O -0.175289 1.202184 -1.680004
O 0.678795 -2.677082 0.692585
N -2.778743 0.167770 -0.478809
N 0.582420 -0.607168 -0.405427
C -1.725460 -0.649573 -1.124185
C -4.139180 -0.426404 -0.700625
C -2.517502 0.438304 0.972946
C -5.212012 0.545195 -0.181522
C -3.574809 1.418465 1.507099
C -4.992412 0.872923 1.300015
C -1.358238 -1.997354 -0.460890
C -0.403440 0.158070 -1.136397
C 0.066579 -1.872526 0.038134
C 1.934833 -0.156610 -0.153800
C 2.626258 -0.617234 0.980407
C 2.551686 0.740808 -1.042798
C 3.928855 -0.179277 1.216701
C 3.852733 1.174089 -0.789783
C 4.554618 0.718873 0.337654
C 5.943994 1.197079 0.607096
H -2.026283 -0.812542 -2.194362
H -4.257110 -1.417860 -0.213162
H -4.276439 -0.577284 -1.793842
H -1.509670 0.901330 1.064711
H -2.510984 -0.485920 1.589820
H -6.214932 0.108872 -0.339833
H -5.178569 1.480668 -0.777514
H -3.469365 2.391486 0.983718
H -3.386155 1.618523 2.577668
H -5.738924 1.614952 1.640143
H -5.151664 -0.028540 1.920973
H -1.438790 -2.843824 -1.169990
H -2.036173 -2.260965 0.374743
H 2.160685 -1.327585 1.667582
H 2.017560 1.113710 -1.920214
H 4.461749 -0.542028 2.094575
H 4.324149 1.874227 -1.478250
H 6.490760 1.430036 -0.316376
H 5.927924 2.113960 1.215194
H 6.541748 0.455451 1.153520


%chk=000299667-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299667

0 1
O -0.254610 1.566670 -0.633601
O 0.973089 -2.900062 0.222108
N -2.860205 0.161288 -0.266848
N 0.700430 -0.570119 -0.198122
C -1.651181 -0.516112 -0.735554
C -4.117888 -0.450980 -0.755059
C -2.896446 0.494889 1.175947
C -5.314690 0.489268 -0.503256
C -4.061964 1.460666 1.476009
C -5.405654 0.869008 0.992685
C -1.279848 -1.910631 -0.133719
C -0.368988 0.328218 -0.521094
C 0.238615 -1.912417 -0.009408
C 2.080851 -0.163527 -0.076275
C 2.910321 -0.744847 0.912273
C 2.608837 0.815632 -0.951989
C 4.258017 -0.343976 1.015530
C 3.956678 1.208367 -0.828965
C 4.806353 0.641043 0.155039
C 6.249103 1.091609 0.298373
H -1.749347 -0.627576 -1.835814
H -4.320859 -1.434952 -0.254525
H -4.012458 -0.649934 -1.838889
H -1.938799 0.971719 1.452116
H -3.019558 -0.421280 1.812992
H -6.246770 -0.004186 -0.839827
H -5.177740 1.404949 -1.109519
H -3.866471 2.417732 0.956773
H -4.094264 1.666317 2.563114
H -6.227510 1.590623 1.157873
H -5.646863 -0.036344 1.588625
H -1.603440 -2.770659 -0.741281
H -1.716762 -2.033387 0.875483
H 2.514331 -1.515327 1.577462
H 1.971974 1.274510 -1.711813
H 4.893841 -0.806478 1.779788
H 4.354841 1.968018 -1.512102
H 6.669951 1.418068 -0.668891
H 6.329598 1.947599 0.996638
H 6.888685 0.283801 0.695221


