%chk=000296605.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296605

0 1
P 0.731904 -1.075414 0.025319
O 1.399788 0.383116 0.537624
O 0.690446 -1.219435 -1.452264
N -0.754871 -1.068917 0.899552
N 1.723095 -2.242441 0.891603
C -1.920533 -0.266900 0.384192
C -4.349692 0.226758 0.886314
C -2.874289 2.018429 -0.097003
C -3.563065 0.037583 -1.499646
C -3.099742 -0.544754 1.360151
C -1.618123 1.255826 0.374849
C -2.311335 -0.737220 -1.037234
C -4.045258 1.740043 0.870034
C -4.735076 -0.239257 -0.533587
C -3.255433 1.550667 -1.518178
C 1.463147 -3.701082 0.684607
C 2.699995 -3.052776 0.100055
C 2.689176 0.681718 0.119956
C 3.051978 0.709928 -1.233444
C 3.577553 1.047747 1.143259
C 4.347955 1.118652 -1.557595
C 4.863256 1.457353 0.789284
C 5.250962 1.491344 -0.556016
H -5.191162 0.023890 1.585909
H -2.655381 3.109655 -0.110875
H -3.839286 -0.297547 -2.524613
H -2.838599 -0.243516 2.388657
H -3.310017 -1.628905 1.396518
H -0.768227 1.494482 -0.291958
H -1.311917 1.600436 1.377346
H -2.503548 -1.824887 -1.042929
H -1.486083 -0.579792 -1.763773
H -4.940054 2.305984 0.558015
H -3.795824 2.092860 1.885356
H -4.981532 -1.315092 -0.530492
H -5.644115 0.285200 -0.874891
H -4.129396 2.114875 -1.885700
H -2.431644 1.762095 -2.223046
H -0.669138 -1.009242 1.934247
H 0.662549 -4.066494 0.033935
H 1.536839 -4.309122 1.594328
H 3.676050 -3.189132 0.580659
H 2.806150 -2.933082 -0.985631
H 2.344325 0.423387 -2.016524
H 3.251507 1.008128 2.179668
H 4.653093 1.149423 -2.603505
H 5.569110 1.749995 1.565796
H 6.255861 1.810031 -0.822330


%chk=000296605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296605

0 1
P 0.704469 -1.046394 -0.000036
O 1.657883 0.204569 0.816424
O 0.669667 -0.892641 -1.595418
N -0.788044 -0.995275 0.806765
N 1.413365 -2.531272 0.701037
C -2.000920 -0.261440 0.346934
C -4.307360 0.497288 1.100941
C -2.955654 1.946854 -0.479433
C -3.945748 -0.240995 -1.298354
C -3.009586 -0.242767 1.528672
C -1.660954 1.205308 -0.047520
C -2.651345 -0.983877 -0.869889
C -3.961732 1.958351 0.703454
C -4.948329 -0.230276 -0.112374
C -3.592156 1.218384 -1.694789
C 1.552358 -3.731629 -0.223245
C 2.785986 -2.971672 0.224454
C 2.940487 0.631416 0.381570
C 3.280338 0.782476 -0.985417
C 3.859630 0.963464 1.403689
C 4.567967 1.263086 -1.316525
C 5.137058 1.452946 1.053356
C 5.499203 1.600626 -0.306829
H -5.015576 0.499007 1.952908
H -2.698542 2.986950 -0.760212
H -4.396988 -0.763970 -2.164413
H -2.549820 0.265235 2.400305
H -3.251069 -1.283404 1.829703
H -0.929729 1.203164 -0.879627
H -1.184838 1.713204 0.813379
H -2.879812 -2.030812 -0.587223
H -1.923747 -1.013006 -1.702944
H -4.885629 2.497023 0.412615
H -3.526172 2.496959 1.569062
H -5.219289 -1.269066 0.165232
H -5.884132 0.285374 -0.406710
H -4.504883 1.755943 -2.021565
H -2.885612 1.217155 -2.547996
H -0.822613 -1.472308 1.710449
H 1.234464 -3.605494 -1.265672
H 1.293142 -4.683658 0.248483
H 3.419782 -3.372621 1.020475
H 3.300113 -2.357438 -0.524114
H 2.547927 0.528937 -1.758635
H 3.559127 0.837028 2.448284
H 4.837574 1.381603 -2.372243
H 5.849235 1.714443 1.844154
H 6.491902 1.977819 -0.575160


