%chk=000271995.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271995

0 1
O 2.092385 -2.243092 0.425711
O 5.370809 1.002020 0.652069
N -0.821802 -0.340761 -0.856226
N 3.191258 1.079259 -0.259188
N 3.935159 -0.863256 0.688184
C 1.993995 0.170301 -0.257491
C 0.862198 0.660066 0.660146
C 1.489542 -0.030091 -1.695457
C -0.357173 -0.271545 0.569170
C 0.250081 -0.938257 -1.721998
C 2.600976 -1.158258 0.306107
C -2.082350 -1.150753 -0.966894
C 4.298778 0.504070 0.407349
C 3.057385 2.543609 -0.361156
C -3.225708 -0.452471 -0.268928
C -4.035820 -1.161774 0.629491
C -3.500841 0.897314 -0.537136
C -5.115548 -0.525168 1.249060
C -4.578397 1.529052 0.087288
C -5.389033 0.819077 0.979878
H 0.556569 1.682842 0.353173
H 1.201550 0.738448 1.709487
H 2.286014 -0.451198 -2.338406
H 1.235042 0.958444 -2.132477
H -0.106334 -1.271628 0.991495
H -1.186396 0.145141 1.183986
H -0.135507 -1.000278 -2.762469
H 0.532234 -1.971451 -1.411409
H -1.961063 -2.190262 -0.587488
H -2.336256 -1.241086 -2.050300
H 4.591719 -1.536289 1.073239
H 2.602822 2.995364 0.536298
H 2.443698 2.798543 -1.242002
H 4.061539 2.991561 -0.500161
H -3.829839 -2.207549 0.847614
H -2.859921 1.447464 -1.227089
H -5.744123 -1.079607 1.943757
H -4.788757 2.576317 -0.122382
H -6.229787 1.312081 1.462856


%chk=000271995-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271995

0 1
O 2.253617 -2.277314 0.463698
O 5.490451 1.146679 0.409684
N -0.810064 -0.415467 -0.733344
N 3.171722 1.142043 -0.149191
N 4.088915 -0.788192 0.546639
C 2.051025 0.158628 -0.178207
C 0.897035 0.570431 0.783619
C 1.479828 -0.019920 -1.616524
C -0.322588 -0.364689 0.670060
C 0.240119 -0.935994 -1.645601
C 2.760219 -1.136296 0.309854
C -2.081351 -1.171151 -0.857637
C 4.372000 0.589593 0.276758
C 3.059867 2.551285 -0.520326
C -3.267879 -0.455453 -0.218019
C -4.256933 -1.187128 0.483645
C -3.424457 0.947190 -0.357502
C -5.387354 -0.534985 1.028893
C -4.549511 1.602294 0.189432
C -5.537726 0.862982 0.882703
H 0.577789 1.594385 0.510180
H 1.264188 0.592955 1.826460
H 2.263643 -0.417866 -2.287631
H 1.183492 0.979685 -1.988280
H -0.056297 -1.381417 1.044077
H -1.135939 0.027926 1.305885
H -0.167673 -0.949579 -2.674075
H 0.538720 -1.978336 -1.383376
H -1.998783 -2.202044 -0.429361
H -2.277088 -1.296434 -1.942163
H 4.807269 -1.432436 0.877880
H 2.343772 3.087561 0.129051
H 2.744729 2.670439 -1.573310
H 4.056387 3.006446 -0.397121
H -4.141369 -2.271569 0.606564
H -2.646559 1.508412 -0.887508
H -6.143964 -1.114641 1.569985
H -4.658783 2.687153 0.075233
H -6.411373 1.371022 1.306577


