%chk=000293705.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293705

0 1
O -2.587085 -0.363426 2.056346
O -3.136061 1.207687 0.466681
O 2.655439 -0.097154 -1.703224
N 2.617866 -0.398195 0.667992
C -1.902518 -0.786207 -0.227639
C -3.017600 -0.217926 0.676264
C -2.391911 -0.808971 -1.686440
C -0.609611 0.031694 -0.062465
C -4.380326 -0.903180 0.521077
C -3.709635 -1.581321 -1.824199
C -4.804553 -0.956553 -0.949498
C 0.586065 -0.632784 -0.744003
C 1.886261 0.149866 -0.506413
C 4.006310 0.119859 0.852090
C 4.768763 -0.117290 -0.475616
C 4.002646 0.447099 -1.678292
C -2.890437 0.838594 2.795322
C -3.283274 1.879149 1.736471
C 4.030894 1.616826 1.237942
C 4.655975 -0.702292 1.981923
C 4.584026 0.008769 -3.016330
H -1.713070 -1.834869 0.116149
H -1.616103 -1.260930 -2.332684
H -2.524813 0.231374 -2.046470
H -0.770005 1.054717 -0.458731
H -0.412423 0.154459 1.023055
H -5.138669 -0.367654 1.120911
H -4.316462 -1.922397 0.950351
H -3.559764 -2.641855 -1.545615
H -4.031205 -1.587025 -2.882614
H -5.023065 0.071714 -1.303980
H -5.746063 -1.527203 -1.048888
H 0.709520 -1.681114 -0.401790
H 0.426974 -0.709220 -1.841276
H 1.720891 1.254003 -0.446228
H 4.896102 -1.211530 -0.614681
H 5.782458 0.311038 -0.422473
H 2.059742 -0.341333 1.522128
H 3.913633 1.554892 -1.615973
H -1.967017 1.078808 3.346093
H -3.702328 0.590578 3.497492
H -4.330180 2.214026 1.811092
H -2.606365 2.746439 1.677693
H 5.054966 1.961817 1.411170
H 3.605731 2.250120 0.453983
H 3.467978 1.805764 2.156266
H 4.553196 -1.778832 1.789295
H 5.722875 -0.480439 2.073294
H 4.191668 -0.504576 2.952601
H 5.625803 0.320293 -3.129016
H 4.536183 -1.083733 -3.124551
H 4.003077 0.426726 -3.848292


%chk=000293705-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293705

0 1
O -2.479658 -0.565814 2.064662
O -3.176941 1.195646 0.628088
O 2.837528 -0.337802 -1.829408
N 2.372096 -0.254236 0.586285
C -1.940749 -0.683448 -0.381976
C -2.984792 -0.277557 0.685743
C -2.542086 -0.485771 -1.800637
C -0.592727 0.047123 -0.178418
C -4.328665 -1.008519 0.519470
C -3.880265 -1.241624 -1.977352
C -4.905370 -0.815089 -0.901920
C 0.542383 -0.498299 -1.073128
C 1.905399 0.119429 -0.741887
C 3.764452 0.195635 0.930485
C 4.741843 -0.167029 -0.237893
C 4.187643 0.238116 -1.626778
C -2.330924 0.723360 2.773469
C -3.305551 1.651787 2.026130
C 3.758566 1.721497 1.204670
C 4.181808 -0.547676 2.217845
C 5.051818 -0.265864 -2.784635
H -1.772247 -1.771894 -0.226739
H -1.814700 -0.828262 -2.560141
H -2.702720 0.598465 -1.966832
H -0.736241 1.128633 -0.369532
H -0.283346 -0.059650 0.877410
H -5.034033 -0.640092 1.287907
H -4.158740 -2.083736 0.723390
H -3.698280 -2.334135 -1.900175
H -4.289149 -1.055257 -2.989190
H -5.157375 0.254316 -1.042525
H -5.844521 -1.391473 -1.006423
H 0.621286 -1.600722 -0.966732
H 0.344644 -0.296486 -2.141155
H 1.856191 1.228544 -0.798785
H 4.903897 -1.264026 -0.239744
H 5.725883 0.317611 -0.077562
H 2.271890 -1.270924 0.729563
H 4.104117 1.348865 -1.680435
H -1.287656 1.086520 2.694156
H -2.596746 0.557037 3.830522
H -4.346185 1.524521 2.386869
H -3.024836 2.716545 2.047354
H 4.754359 2.051287 1.553982
H 3.506773 2.312303 0.306141
H 3.012775 1.955392 1.984056
H 4.162725 -1.644768 2.067028
H 5.207526 -0.266479 2.516981
H 3.492875 -0.300423 3.045549
H 6.076476 0.143801 -2.715623
H 5.110546 -1.368808 -2.764776
H 4.613501 0.037733 -3.751056


