%chk=000296598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296598

0 1
P -1.478255 0.401882 -0.310320
O -1.125414 0.304535 -1.765215
N -0.107675 0.501431 0.775674
N -2.453350 1.817572 0.119457
C 1.286179 0.295361 0.261116
C 2.958828 -1.282470 -0.783782
C 3.095186 1.192851 -1.248637
C 3.697838 0.303302 1.030465
C 1.487839 -1.121926 -0.343842
C 1.625232 1.362329 -0.809681
C 2.232901 0.469420 1.484345
C 3.292594 -0.215938 -1.849416
C 3.893198 -1.106368 0.432532
C 4.030806 1.370592 -0.033524
C -1.807989 3.166785 0.104575
C -2.781486 2.772841 -0.984521
C -2.497560 -0.988749 0.345564
C -3.249784 -0.843951 1.509173
C -2.488726 -2.183581 -0.372830
C -3.997260 -1.932449 1.977054
C -3.236713 -3.269173 0.099512
C -3.986650 -3.141658 1.273697
H 3.101601 -2.297539 -1.217243
H 3.335707 1.960629 -2.017706
H 4.369982 0.431256 1.908247
H 0.830015 -1.263235 -1.224864
H 1.215528 -1.902595 0.383381
H 1.453520 2.375890 -0.411629
H 0.962369 1.252829 -1.695792
H 1.996790 -0.267175 2.270468
H 2.083307 1.466679 1.935400
H 4.328868 -0.339990 -2.205957
H 2.641393 -0.345136 -2.733037
H 3.682689 -1.878077 1.192383
H 4.944618 -1.249918 0.129190
H 5.085152 1.282034 -0.347053
H 3.917891 2.382859 0.391088
H -0.242579 0.101200 1.718866
H -0.743596 3.300009 -0.111446
H -2.126813 3.831297 0.915508
H -3.808810 3.152581 -0.972773
H -2.434616 2.602835 -2.012467
H -3.282964 0.102490 2.056555
H -1.918962 -2.287946 -1.302343
H -4.591041 -1.834939 2.883380
H -3.239234 -4.208405 -0.449714
H -4.569254 -3.986770 1.639263


%chk=000296598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296598

0 1
P -1.401570 0.155339 -0.310580
O -1.164502 -0.000992 -1.899731
N 0.011135 -0.081039 0.663576
N -2.072325 1.754503 0.208555
C 1.425837 0.043600 0.224772
C 3.387827 -1.098404 -0.946485
C 3.131052 1.420903 -1.069560
C 3.797300 0.322861 1.115360
C 1.889440 -1.224010 -0.558038
C 1.633539 1.294539 -0.676348
C 2.298760 0.197884 1.502970
C 3.577340 0.152552 -1.846412
C 4.243459 -0.947457 0.341716
C 3.991923 1.572348 0.213490
C -1.653121 2.987750 -0.562659
C -3.052125 2.429226 -0.737731
C -2.663890 -1.004423 0.408152
C -3.308634 -0.728501 1.637146
C -2.975320 -2.172594 -0.326141
C -4.257575 -1.646070 2.144058
C -3.928297 -3.082195 0.183662
C -4.565120 -2.822247 1.420427
H 3.701289 -2.006226 -1.499025
H 3.259745 2.314420 -1.711921
H 4.401757 0.429942 2.037833
H 1.255267 -1.334151 -1.458425
H 1.729610 -2.119334 0.076907
H 1.305640 2.197621 -0.123363
H 1.006840 1.197503 -1.583920
H 2.153611 -0.685517 2.160914
H 1.966656 1.092017 2.066093
H 4.639793 0.248226 -2.148357
H 2.978686 0.046400 -2.772535
H 4.124973 -1.844686 0.982427
H 5.317645 -0.871173 0.079139
H 5.061853 1.678859 -0.056155
H 3.698621 2.489021 0.763957
H -0.136335 -0.562412 1.554478
H -0.961955 2.856578 -1.404339
H -1.486823 3.872360 0.059897
H -3.902598 2.904585 -0.239704
H -3.268656 1.927597 -1.689535
H -3.085720 0.201567 2.171103
H -2.483187 -2.346873 -1.289939
H -4.760985 -1.439738 3.095013
H -4.175631 -3.987192 -0.381907
H -5.303928 -3.529467 1.814266


