%chk=000254238.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254238

0 1
P 1.960014 0.635856 0.426506
O 1.625463 -0.976653 0.554632
O 2.602440 0.793610 -1.099803
O 2.807564 1.102253 1.541288
O -3.865091 -0.020947 -1.193947
O -4.010061 -0.131670 1.093812
N -2.769780 1.542708 0.005030
C 0.328737 1.499546 0.128571
C -0.613530 1.157522 1.272774
C -1.945714 1.923927 1.179306
C 1.012110 -1.627701 -0.593705
C 4.048917 0.697230 -1.194577
C 1.420018 -3.082968 -0.448729
C 4.497218 -0.753197 -1.191708
C -3.570134 0.401860 0.098995
C -4.906128 -1.028969 -1.297568
H -0.083455 1.211511 -0.855776
H 0.507357 2.593236 0.067677
H -0.154105 1.403847 2.258805
H -0.824713 0.065339 1.314342
H -2.545004 1.747818 2.106620
H -1.767700 3.021319 1.112943
H -0.082948 -1.494787 -0.495832
H 1.373566 -1.190564 -1.545051
H 4.529016 1.290073 -0.389862
H 4.230113 1.186422 -2.173435
H -2.381058 1.774478 -0.909912
H 2.497748 -3.216543 -0.606753
H 1.212388 -3.441972 0.571282
H 0.883342 -3.727606 -1.152281
H 4.415197 -1.218899 -0.198556
H 3.898353 -1.359679 -1.883072
H 5.547228 -0.840439 -1.497262
H -4.751020 -1.817593 -0.552291
H -5.876884 -0.544096 -1.155180
H -4.778964 -1.398173 -2.320484


%chk=000254238-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254238

0 1
P 1.937458 0.692639 0.414123
O 1.621436 -0.995739 0.713999
O 2.438076 0.794596 -1.258147
O 2.989658 1.256968 1.465541
O -3.851928 0.352085 -1.355330
O -2.735220 -0.744949 0.411585
N -2.740828 1.600647 0.181101
C 0.276259 1.538026 0.294527
C -0.609693 1.256109 1.522571
C -2.002186 1.923991 1.417056
C 0.757393 -1.776641 -0.222484
C 3.901055 0.725248 -1.542872
C 0.923181 -3.242085 0.172119
C 4.409903 -0.719963 -1.563786
C -3.070502 0.316392 -0.180994
C -4.258911 -0.971207 -1.870005
H -0.198206 1.184060 -0.636575
H 0.493878 2.615150 0.179106
H -0.121418 1.635396 2.440437
H -0.746596 0.169242 1.652650
H -2.598014 1.621504 2.300297
H -1.898240 3.023993 1.443326
H -0.295667 -1.452681 -0.106017
H 1.089542 -1.592837 -1.262891
H 4.439101 1.327461 -0.786081
H 3.994103 1.207900 -2.530105
H -3.104265 2.351444 -0.406279
H 1.973291 -3.561277 0.058869
H 0.624027 -3.392246 1.223059
H 0.285417 -3.880721 -0.467350
H 4.311072 -1.186386 -0.567858
H 3.846875 -1.324843 -2.296293
H 5.478910 -0.737142 -1.848522
H -3.376620 -1.545076 -2.202208
H -4.790164 -1.543750 -1.091303
H -4.921680 -0.749210 -2.718468


