%chk=000191466.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191466

0 1
P 3.687940 1.815350 -0.698535
P 2.135205 3.475671 1.395132
P -0.060722 1.382875 0.666334
F -7.727792 2.934046 1.596616
O 3.222478 -2.678740 1.305275
O 3.714602 -5.217233 -0.490641
O 5.141800 -3.285730 -1.223543
O 4.184068 0.357693 -0.187722
O 3.324384 2.554413 0.721434
O 5.106512 2.490027 -1.083985
O 2.599918 1.922796 -1.690641
O 0.808418 2.782301 0.701939
O 2.118229 4.797511 0.454057
O 2.251277 3.608693 2.827279
O -4.183037 -0.530750 -2.323942
O 0.504137 0.755883 -0.705188
O 0.777987 0.495916 1.759830
O -1.497545 1.518883 0.881405
N 0.985748 -3.071419 0.696205
N -0.899369 -2.034103 1.530247
N 0.622579 -2.552146 -1.738417
N -1.486721 -1.378879 -2.141973
N -2.955264 -0.695102 -0.356826
C 2.920989 -4.056240 -0.629117
C 3.799694 -2.829649 -1.023937
C 2.335885 -3.669345 0.760543
C 3.868695 -1.933313 0.233197
C 3.124377 -0.598995 0.124870
C 0.304418 -2.523508 -0.405836
C 0.202905 -2.715707 1.850030
C -0.881929 -1.904919 0.127980
C -1.796038 -1.323256 -0.808515
C -0.318559 -1.970605 -2.536569
C -4.045409 -0.215548 -1.171089
C -5.000307 0.629792 -0.391834
C -6.370204 0.333058 -0.495953
C -4.559329 1.718767 0.374485
C -7.309211 1.109761 0.182574
C -5.484134 2.512482 1.056496
C -6.838556 2.184864 0.945329
H 2.156325 -4.342650 -1.387819
H 3.429726 -2.309736 -1.930787
H 2.351380 -4.500719 1.506510
H 4.919758 -1.788619 0.584501
H 2.687557 -0.330113 1.117853
H 2.336280 -0.595674 -0.657503
H 4.599739 -4.990507 -0.085837
H 5.198671 -3.809513 -2.058549
H 0.513298 -3.005012 2.846984
H -0.120859 -1.968947 -3.623699
H -2.978457 -0.488175 0.658659
H 5.857344 2.380543 -0.424799
H 1.598352 4.746932 -0.403350
H -6.698245 -0.505908 -1.115753
H -3.487102 1.956706 0.440526
H -8.373290 0.887283 0.113345
H -5.151536 3.360173 1.655259
H 0.997691 1.376600 -1.393362
H 0.261547 0.031941 2.481024


%chk=000191466-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191466

0 1
P 4.298255 1.564597 -0.024930
P 2.201758 3.478755 1.558120
P -0.043067 1.349466 0.686341
F -7.416481 3.914793 -0.278708
O 3.398136 -3.202940 1.001560
O 3.867070 -4.119742 -1.803347
O 4.093669 -1.415593 -2.136168
O 4.983630 0.206891 0.760282
O 3.418926 2.262807 1.262296
O 5.670303 2.497619 -0.318792
O 3.472612 1.288536 -1.363063
O 0.786966 2.920133 0.802504
O 2.763305 4.614591 0.408049
O 2.158455 3.883619 3.075609
O -5.071214 -2.052320 -0.132012
O 1.189108 0.479995 -0.167334
O -0.128759 0.631291 2.134333
O -1.386972 1.527015 -0.159657
N 1.058896 -3.243660 0.479823
N -0.350458 -1.783482 1.436432
N -0.419970 -4.035758 -1.355551
N -2.547945 -2.820502 -1.443183
N -3.028848 -0.910573 -0.082918
C 2.774169 -3.294146 -1.317898
C 3.277318 -1.857475 -1.020971
C 2.419768 -3.794623 0.097910
C 4.085868 -2.057145 0.291256
C 4.104606 -0.886769 1.287209
C -0.130320 -3.253800 -0.290023
C 0.866675 -2.366051 1.511203
C -0.996958 -2.280099 0.290700
C -2.220912 -2.005108 -0.393834
C -1.678158 -3.789554 -1.844494
C -4.455001 -0.953318 -0.150674
C -5.164207 0.368033 -0.181797
C -6.574167 0.330701 0.001433
C -4.519095 1.615634 -0.403027
C -7.338405 1.510763 -0.027993
C -5.273818 2.807138 -0.435921
C -6.663787 2.726703 -0.246435
H 1.914453 -3.318530 -2.010163
H 2.416149 -1.183464 -0.850697
H 2.433485 -4.888629 0.204519
H 5.113576 -2.378842 0.050006
H 4.586790 -1.187751 2.230222
H 3.093382 -0.490313 1.487817
H 4.375490 -3.567223 -2.456813
H 4.013622 -0.423674 -2.217737
H 1.612759 -2.147218 2.265593
H -2.008006 -4.423899 -2.671256
H -2.542757 -0.007009 0.093135
H 6.270696 2.655902 0.455210
H 2.130819 5.334535 0.155940
H -7.048920 -0.642591 0.159286
H -3.436955 1.689761 -0.553741
H -8.422813 1.500944 0.111885
H -4.798096 3.776962 -0.605264
H 1.728942 0.950325 -0.877363
H -0.487273 -0.805509 1.933287


