%chk=000207550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207550

0 1
O -0.659548 -2.601689 0.186567
O 4.881926 0.484295 0.070682
N -3.994760 -0.025092 0.105128
C -5.223684 -0.534087 0.800741
C -4.324551 0.472341 -1.271867
C -6.262480 0.594031 0.918322
C -5.347935 1.616878 -1.184049
C -6.621364 1.161438 -0.460578
C -2.938207 -1.087396 0.050972
C -1.561742 -0.400537 0.030132
C -0.437593 -1.406629 0.117178
C 0.959072 -0.890570 0.106602
C 1.268536 0.483352 0.119755
C 2.587066 0.926333 0.109712
C 2.000630 -1.829869 0.089274
C 3.621712 -0.050757 0.086863
C 2.917234 2.392833 0.134347
C 3.335528 -1.421924 0.076330
C 2.731245 2.987057 1.530108
C 6.029144 -0.429288 0.031389
C 7.214299 0.514761 0.012640
H -4.922957 -0.866576 1.818279
H -5.674353 -1.411338 0.288973
H -4.712036 -0.330446 -1.935920
H -3.385148 0.847938 -1.731318
H -7.165634 0.215659 1.429605
H -5.853470 1.402225 1.557515
H -4.897092 2.470717 -0.639674
H -5.587263 1.981509 -2.198823
H -7.149209 0.397495 -1.061841
H -7.323284 2.008589 -0.353557
H -3.000919 -1.736337 0.953555
H -3.034321 -1.771968 -0.819031
H -1.504539 0.319247 0.876123
H -1.453305 0.216720 -0.884113
H 0.466616 1.224005 0.142285
H 1.753551 -2.897534 0.086091
H 2.286750 2.935557 -0.598906
H 3.967103 2.549955 -0.199969
H 4.122547 -2.167906 0.061754
H 1.697693 2.886545 1.879728
H 2.986513 4.052055 1.544376
H 3.373091 2.482295 2.263008
H 5.998521 -1.062482 0.934556
H 5.953852 -1.043444 -0.882095
H 8.162609 -0.034838 0.007036
H 7.193102 1.167179 -0.871561
H 7.209955 1.177497 0.889976


%chk=000207550-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207550

0 1
O -0.710962 -2.640348 0.336946
O 4.913641 0.533134 0.103994
N -4.124498 -0.116411 0.150384
C -5.392757 -0.801780 0.516930
C -4.314316 0.752942 -1.040157
C -6.511398 0.214919 0.821542
C -5.401769 1.817713 -0.789761
C -6.737231 1.155004 -0.384014
C -3.014743 -1.089034 -0.015172
C -1.634985 -0.407872 -0.003761
C -0.481158 -1.402256 0.168978
C 0.923023 -0.883104 0.148849
C 1.239586 0.494968 -0.017352
C 2.566455 0.966956 -0.030544
C 1.989867 -1.805852 0.301522
C 3.615348 0.008740 0.127522
C 2.884903 2.445098 -0.182591
C 3.326225 -1.371567 0.290056
C 3.231401 3.126013 1.168761
C 6.053492 -0.401378 0.232242
C 7.323538 0.441948 0.165314
H -5.198831 -1.432147 1.404839
H -5.735357 -1.484219 -0.307304
H -4.598525 0.140443 -1.939109
H -3.356163 1.251313 -1.274980
H -7.442363 -0.327866 1.075503
H -6.217381 0.812315 1.706300
H -5.061513 2.488244 0.023107
H -5.530466 2.432241 -1.701866
H -7.131892 0.567868 -1.239539
H -7.495432 1.923929 -0.142290
H -3.053318 -1.803630 0.826020
H -3.124176 -1.699018 -0.947099
H -1.611884 0.324532 0.829195
H -1.463495 0.174986 -0.930161
H 0.435284 1.229437 -0.139038
H 1.741233 -2.864744 0.428330
H 2.017121 2.958004 -0.638947
H 3.742271 2.570530 -0.869269
H 4.130592 -2.103380 0.406681
H 2.390727 3.044383 1.881413
H 3.452852 4.198606 1.018207
H 4.118256 2.652797 1.624540
H 5.977177 -0.941039 1.197919
H 6.013955 -1.141113 -0.592750
H 8.213261 -0.206885 0.258657
H 7.383626 0.982048 -0.794782
H 7.343680 1.182332 0.983034


