%chk=000243253.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243253

0 1
O 0.016354 1.948543 1.831563
O -5.437564 -0.882886 -0.349285
N 2.752836 -0.014696 0.424485
C 3.961447 0.359673 -0.399826
C 4.589818 -0.926800 -0.985489
C 3.121912 -0.958579 1.534594
C 4.971088 -1.921458 0.114922
C 3.737661 -2.244855 0.964568
C 2.054996 1.180093 0.995752
C 0.539188 0.887245 0.998966
C 3.548137 1.286732 -1.552977
C -0.083124 0.945518 -0.405281
C -1.517311 0.506134 -0.399971
C -1.831485 -0.868137 -0.361564
C -2.551668 1.447890 -0.425985
C -3.152685 -1.293326 -0.345753
C -3.892901 1.045868 -0.410533
C -4.177310 -0.322264 -0.370359
C -6.574532 0.011837 -0.379413
H 4.728555 0.882557 0.229380
H 5.476293 -0.661551 -1.588770
H 3.869769 -1.402203 -1.681149
H 2.190535 -1.207998 2.088897
H 3.820558 -0.499455 2.267888
H 5.776136 -1.504966 0.749218
H 5.381382 -2.845582 -0.332668
H 2.984899 -2.772590 0.345315
H 4.000284 -2.930678 1.790014
H 2.252407 2.094924 0.394443
H 2.371044 1.439689 2.030459
H 0.305610 -0.076944 1.501975
H 3.149676 2.240759 -1.184679
H 4.398782 1.511644 -2.203465
H 2.765221 0.827894 -2.169817
H 0.521370 0.298138 -1.081202
H 0.019996 1.969178 -0.816557
H -0.959495 1.953856 1.803025
H -1.025666 -1.603303 -0.345298
H -2.319045 2.512280 -0.463546
H -3.416169 -2.348014 -0.316912
H -4.679891 1.791120 -0.432721
H -6.578225 0.652372 0.506971
H -7.415552 -0.693551 -0.357892
H -6.576132 0.594492 -1.304924


%chk=000243253-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243253

0 1
O -0.117957 1.918441 1.720562
O -5.636987 -0.830022 -0.248134
N 2.829640 0.046041 0.398248
C 4.061408 0.441008 -0.360074
C 4.728521 -0.831970 -0.945504
C 3.137152 -0.935310 1.476468
C 5.039351 -1.893999 0.129296
C 3.758317 -2.228445 0.920663
C 2.020644 1.169361 0.939884
C 0.516597 0.829190 0.956036
C 3.754282 1.426239 -1.507992
C -0.078173 0.715560 -0.472223
C -1.549761 0.339940 -0.456867
C -1.956886 -1.020708 -0.359545
C -2.562607 1.330949 -0.481782
C -3.315191 -1.376490 -0.292504
C -3.936611 0.994313 -0.414916
C -4.312098 -0.367239 -0.317677
C -6.703115 0.172968 -0.277060
H 4.801583 0.922723 0.335341
H 5.657001 -0.533398 -1.470122
H 4.041022 -1.260156 -1.702565
H 2.199433 -1.167023 2.013705
H 3.840060 -0.487878 2.228877
H 5.808435 -1.501372 0.826809
H 5.462717 -2.803379 -0.338410
H 3.025180 -2.724669 0.255435
H 3.979437 -2.921026 1.755862
H 2.149808 2.071632 0.321033
H 2.322194 1.441491 1.978450
H 0.352923 -0.137194 1.482255
H 3.483110 2.436810 -1.156516
H 4.648821 1.532658 -2.148300
H 2.926560 1.038678 -2.130405
H 0.525495 -0.038328 -1.011158
H 0.065166 1.691041 -0.976727
H -1.101321 1.786988 1.682656
H -1.194557 -1.809368 -0.346051
H -2.276963 2.385590 -0.582323
H -3.631563 -2.422068 -0.225233
H -4.688653 1.788800 -0.445087
H -6.629937 0.865112 0.584778
H -7.639478 -0.400516 -0.212505
H -6.685798 0.753626 -1.220279


