%chk=000224780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224780

0 1
P 1.632354 -0.784019 0.411920
P -1.315571 -0.288107 1.413929
P -0.104396 1.595367 -0.943281
O 0.020606 -1.313008 0.835612
O 1.225996 0.501173 -0.725151
O -1.309921 0.902654 0.158332
O 2.567670 -0.312229 1.574015
O -1.160257 0.256188 2.891919
O -0.688317 1.658910 -2.413262
N 2.217796 -2.048122 -0.559588
N -2.705060 -1.220411 1.109459
N 0.428720 3.071486 -0.283518
C 3.606982 -2.537352 -0.323690
C 1.427136 -2.561663 -1.708240
C -3.517347 -1.670691 2.276478
C -3.067965 -1.653318 -0.262833
C 1.206428 3.137111 0.985947
C -0.057108 4.331881 -0.919043
C 4.715868 -1.605296 -0.854603
C 1.916638 -2.067602 -3.084541
C -2.895308 -2.835261 3.074517
C -2.784411 -3.142925 -0.546644
C 0.375920 3.519074 2.228647
C -1.548632 4.641474 -0.672690
H 3.746947 -2.692433 0.761701
H 3.662729 -3.529871 -0.808487
H 1.454681 -3.668249 -1.657931
H 0.374390 -2.263606 -1.556441
H -3.679363 -0.808544 2.949020
H -4.502071 -1.959688 1.864670
H -4.144269 -1.432462 -0.405045
H -2.523049 -1.013720 -0.979855
H 1.705205 2.164228 1.151930
H 2.017180 3.873570 0.820861
H 0.579150 5.137304 -0.508844
H 0.135263 4.276534 -2.006335
H 4.612531 -1.424910 -1.937870
H 4.683912 -0.634015 -0.330857
H 5.707063 -2.059504 -0.668566
H 1.891102 -0.965835 -3.129035
H 2.944687 -2.409586 -3.297349
H 1.257030 -2.464073 -3.878623
H -2.712755 -3.714143 2.433076
H -1.936767 -2.525230 3.526475
H -3.575082 -3.134641 3.894042
H -1.717510 -3.372225 -0.379279
H -3.386985 -3.802177 0.103147
H -3.039138 -3.378917 -1.596670
H -0.110706 4.503180 2.104703
H -0.395218 2.759942 2.444510
H 1.044165 3.577750 3.107503
H -2.186975 3.863276 -1.127225
H -1.777706 4.695615 0.404910
H -1.811960 5.609718 -1.137930


%chk=000224780-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224780

0 1
P 1.805539 -1.023746 0.688757
P -1.099279 -0.555242 1.936091
P 0.001176 1.375354 -0.338803
O 0.134721 -1.457708 1.041564
O 1.515354 0.592454 0.032097
O -0.945960 0.979943 1.087960
O 2.838281 -1.056590 1.885989
O -0.929899 -0.442372 3.504624
O -0.677743 0.908707 -1.700514
N 2.190750 -1.999033 -0.650541
N -2.555915 -1.254327 1.398705
N 0.355916 3.026340 -0.191773
C 3.381375 -2.892142 -0.560535
C 1.356032 -1.997482 -1.880127
C -3.456853 -1.869190 2.416569
C -2.888627 -1.354236 -0.045545
C 1.055461 3.553241 1.011710
C -0.156642 3.962494 -1.232926
C 4.726499 -2.171496 -0.782514
C 2.107118 -1.490124 -3.126003
C -2.964487 -3.222046 2.970940
C -2.684915 -2.764480 -0.636734
C 0.129057 4.279340 2.006231
C -1.669007 4.253296 -1.142822
H 3.389043 -3.385602 0.428941
H 3.227341 -3.682049 -1.319305
H 0.982702 -3.028551 -2.044440
H 0.472179 -1.355935 -1.711941
H -3.591225 -1.156599 3.250993
H -4.437037 -1.984258 1.917745
H -3.943320 -1.035180 -0.161150
H -2.277209 -0.623591 -0.607381
H 1.560086 2.707984 1.511503
H 1.854700 4.231093 0.652776
H 0.428493 4.892759 -1.111533
H 0.081269 3.550616 -2.230946
H 4.756007 -1.664667 -1.761921
H 4.891333 -1.420447 0.009279
H 5.556579 -2.901507 -0.740154
H 2.460189 -0.456847 -2.967950
H 2.974768 -2.128081 -3.372403
H 1.423376 -1.494048 -3.994412
H -2.797164 -3.953238 2.161901
H -2.020182 -3.089605 3.527476
H -3.714499 -3.637240 3.669915
H -1.637282 -3.085066 -0.504952
H -3.343469 -3.508781 -0.154527
H -2.919264 -2.752205 -1.717413
H -0.345834 5.165946 1.549429
H -0.660772 3.597449 2.364370
H 0.716757 4.621038 2.878152
H -2.249826 3.330703 -1.318104
H -1.944630 4.659103 -0.154968
H -1.956759 4.988453 -1.917487


