%chk=000275758.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275758

0 1
P 2.333742 -0.004530 0.057553
O 1.944387 -1.204080 -1.011438
O 1.949023 1.196654 -1.011282
O 3.663749 -0.007135 0.680541
O -4.888746 0.009536 -0.876670
O -5.399446 0.010590 1.319331
N 1.082316 -0.002203 1.270617
C -0.305740 0.000537 1.020805
C -0.832531 0.001591 -0.291081
C -1.182967 0.002247 2.134188
C -3.081908 0.006000 0.624875
C -2.209953 0.004301 -0.477398
C -2.556190 0.004949 1.930617
C 2.080061 -2.508622 -0.510213
C 2.089664 2.500594 -0.509862
C -4.544347 0.008878 0.458203
C 3.344554 -3.064227 -0.286529
C 3.356266 3.051333 -0.286078
C 0.890949 -3.233171 -0.360926
C 0.903326 3.229657 -0.360484
C 3.405934 -4.404691 0.105757
C 3.422759 4.391494 0.106409
C 0.983616 -4.571497 0.026913
C 1.001097 4.567562 0.027556
C 2.234762 -5.154620 0.262149
C 2.254457 5.145867 0.262897
C -6.327285 0.012382 -1.182232
C -6.375359 0.012269 -2.694816
H 1.362713 -0.002794 2.270957
H -0.180364 0.000321 -1.169435
H -0.787196 0.001456 3.146960
H -2.627748 0.005135 -1.490184
H -3.243648 0.006291 2.783420
H 4.254107 -2.474885 -0.412777
H 4.263564 2.458541 -0.412404
H -0.069501 -2.757146 -0.555347
H -0.058933 2.757334 -0.554993
H 4.376980 -4.865968 0.288441
H 4.395557 4.849033 0.289174
H 0.075374 -5.162345 0.147171
H 0.095117 5.161856 0.147888
H 2.296662 -6.198126 0.566919
H 2.320337 6.189084 0.567823
H -6.764480 0.916497 -0.724606
H -6.768123 -0.889835 -0.724355
H -5.870868 -0.870086 -3.112086
H -5.867296 0.892457 -3.112330
H -7.409744 0.014316 -3.058538


%chk=000275758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275758

0 1
P 2.329077 -0.004882 0.293292
O 2.028256 -1.254829 -0.869148
O 2.032211 1.246060 -0.869087
O 3.705142 -0.007076 1.086392
O -5.054902 0.010532 -0.804512
O -5.519159 0.012571 1.481900
N 0.996759 -0.002747 1.411210
C -0.394798 0.000155 1.145462
C -0.914300 0.000680 -0.179135
C -1.291045 0.002781 2.250798
C -3.203000 0.006584 0.716158
C -2.305114 0.003907 -0.382836
C -2.677637 0.005923 2.034582
C 2.184523 -2.635057 -0.514133
C 2.193234 2.625711 -0.513944
C -4.678806 0.010124 0.544974
C 3.375139 -3.119471 0.070948
C 3.386413 3.106228 0.069122
C 1.115454 -3.490239 -0.851434
C 1.126198 3.484295 -0.849008
C 3.483620 -4.506001 0.323802
C 3.499698 4.492339 0.322160
C 1.247448 -4.874483 -0.602434
C 1.262962 4.868053 -0.599844
C 2.427765 -5.384916 -0.012415
C 2.445966 5.374629 -0.011880
C -6.524668 0.014069 -1.066431
C -6.702552 0.014251 -2.581299
H 1.289539 -0.003167 2.392389
H -0.237104 -0.001376 -1.038217
H -0.896902 0.002417 3.274060
H -2.709936 0.004354 -1.398705
H -3.377046 0.007999 2.876964
H 4.189811 -2.432163 0.319656
H 4.199343 2.416281 0.316216
H 0.210186 -3.069740 -1.299360
H 0.218798 3.066721 -1.295357
H 4.400531 -4.897024 0.777883
H 4.418648 4.880374 0.774678
H 0.426134 -5.549942 -0.864835
H 0.443275 5.546149 -0.860520
H 2.523977 -6.458338 0.182051
H 2.545886 6.447691 0.182704
H -6.961494 0.909216 -0.587478
H -6.965839 -0.878792 -0.587187
H -6.244094 -0.882220 -3.032850
H -6.239592 0.908254 -3.033147
H -7.779304 0.016914 -2.831102


