%chk=000229788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229788

0 1
P -1.966005 0.416043 -0.269274
O -0.962380 1.653429 -0.719302
O -1.614177 0.291282 1.332539
O -3.392601 1.197176 -0.185124
O -1.938306 -0.788970 -1.114394
C 1.113212 0.418305 -1.053027
C 3.051746 0.137889 0.394157
C 0.075267 1.314736 -1.673231
C 3.066306 -1.244454 0.098735
C 2.073157 0.955500 -0.185174
C 1.119379 -0.953950 -1.332519
C 2.093419 -1.774617 -0.760674
C 4.067670 0.736940 1.313127
C 4.102323 -2.144236 0.691114
C -0.745126 -0.789742 1.761366
C -3.414578 2.394727 0.662355
C -1.421364 -2.141270 1.633123
C -4.830966 2.909993 0.494554
H 0.479589 2.318803 -1.920298
H -0.379618 0.877835 -2.585575
H 2.049912 2.020862 0.044369
H 0.349084 -1.387375 -1.978520
H 2.092887 -2.839942 -0.987900
H 5.085783 0.605786 0.919121
H 3.917910 1.813966 1.463995
H 4.037414 0.266041 2.305739
H 3.982699 -3.190095 0.379502
H 5.114523 -1.834201 0.392971
H 4.066698 -2.128438 1.789581
H 0.216713 -0.737214 1.214368
H -0.578106 -0.507582 2.821721
H -3.195890 2.095398 1.706284
H -2.658469 3.114050 0.291713
H -0.856085 -2.919545 2.157168
H -2.436350 -2.126426 2.052238
H -1.519548 -2.463392 0.581454
H -5.007378 3.809215 1.093483
H -5.042686 3.147292 -0.557488
H -5.564459 2.146880 0.791725


%chk=000229788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229788

0 1
P -2.268222 0.396190 -0.221154
O -0.920894 1.498680 -0.274048
O -2.320766 -0.003940 1.455984
O -3.664768 1.374711 -0.331974
O -2.216833 -0.759768 -1.307098
C 1.224086 0.394450 -0.908020
C 3.348090 0.069293 0.323701
C 0.109640 1.305639 -1.362601
C 3.321054 -1.323307 -0.002076
C 2.300891 0.901212 -0.137174
C 1.203905 -0.985519 -1.226934
C 2.244409 -1.825522 -0.774720
C 4.484657 0.651917 1.144983
C 4.428387 -2.251461 0.463399
C -1.177703 -0.761484 2.054958
C -3.848028 2.529845 0.605885
C -1.281626 -2.260766 1.763796
C -5.150089 3.200678 0.182062
H 0.459784 2.335546 -1.540475
H -0.394722 0.912458 -2.263238
H 2.320381 1.970212 0.111972
H 0.372055 -1.393466 -1.812287
H 2.224574 -2.892196 -1.028415
H 5.464658 0.493409 0.654951
H 4.354466 1.736997 1.295350
H 4.550971 0.178654 2.143879
H 4.242695 -3.289072 0.138485
H 5.413321 -1.942589 0.062494
H 4.523343 -2.252959 1.566472
H -0.225154 -0.334600 1.686104
H -1.275690 -0.543960 3.131476
H -3.893982 2.138101 1.637709
H -2.978382 3.206377 0.507880
H -0.468004 -2.797739 2.287337
H -2.248113 -2.660153 2.115821
H -1.192142 -2.461315 0.682566
H -5.356226 4.066772 0.838426
H -5.085468 3.555917 -0.860180
H -5.992956 2.493457 0.258706


