%chk=000180177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180177

0 1
F -2.038354 0.861312 -1.070606
F -2.291250 -3.181674 1.361617
F -3.822420 -1.971170 3.219940
F -3.568998 2.079840 0.791522
F -4.473532 0.672682 2.956727
O 0.119805 -1.284252 -0.842220
O 1.197202 3.369624 -1.049118
O 3.072922 3.588673 -2.488024
O 0.734682 -3.044306 0.478910
N 2.257131 -1.338352 -0.018702
C 3.392682 -1.941693 0.781412
C 2.485653 -0.084437 -0.698700
C 3.771708 -3.302104 0.197164
C 2.987276 -2.045871 2.251579
C 1.593313 0.998165 -0.452392
C 1.887168 2.169458 -1.106794
C 3.586735 0.035662 -1.552767
C 1.028285 -1.992363 -0.052368
C 3.017943 2.299312 -1.971688
C 3.878533 1.253092 -2.209811
C -1.215864 -1.851418 -0.946920
C 1.921518 4.298158 -1.925095
C -2.095454 -1.200253 0.083706
C -2.454831 0.155470 -0.026998
C -2.579839 -1.897019 1.203696
C -3.383245 -1.276464 2.175910
C -3.253650 0.796853 0.932990
C -3.719565 0.077634 2.043274
H 4.259312 -1.233086 0.686227
H 4.626932 -3.735132 0.727334
H 2.940607 -4.021780 0.284410
H 4.031228 -3.238918 -0.864845
H 2.689216 -1.075857 2.665063
H 3.812214 -2.429569 2.861732
H 2.137026 -2.734141 2.389673
H 0.725358 0.885405 0.193235
H 4.235472 -0.820468 -1.736145
H 4.735306 1.345931 -2.871949
H -1.165628 -2.955387 -0.853374
H -1.497673 -1.577273 -1.984437
H 2.300884 5.118911 -1.302450
H 1.252993 4.569003 -2.753019


%chk=000180177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180177

0 1
F -1.911326 1.122029 -0.144036
F -2.596737 -3.638339 0.453809
F -4.070737 -3.138029 2.743735
F -3.397372 1.618675 2.146303
F -4.479011 -0.510830 3.601881
O 0.015268 -0.991246 -1.009193
O 1.737184 3.668232 -1.414416
O 3.678827 3.527306 -2.819949
O 0.434478 -2.660257 0.584909
N 2.113289 -1.125345 -0.037662
C 3.140821 -1.751987 0.880110
C 2.503566 0.039386 -0.807890
C 3.450357 -3.214472 0.491963
C 2.728629 -1.605800 2.362181
C 1.786908 1.264369 -0.670149
C 2.259155 2.350611 -1.403772
C 3.646863 -0.045406 -1.640667
C 0.846960 -1.672745 -0.082448
C 3.402559 2.269581 -2.228572
C 4.122712 1.081827 -2.363524
C -1.354618 -1.545775 -1.122062
C 2.526984 4.392983 -2.445082
C -2.191749 -1.272625 0.113462
C -2.433845 0.041153 0.568510
C -2.765004 -2.320531 0.864509
C -3.525166 -2.082739 2.025956
C -3.185940 0.311799 1.727167
C -3.732383 -0.759371 2.460384
H 4.047973 -1.143306 0.715597
H 4.278188 -3.593948 1.118103
H 2.568813 -3.855963 0.651958
H 3.756172 -3.291415 -0.567251
H 2.533291 -0.547545 2.612616
H 3.547436 -1.967326 3.010500
H 1.825026 -2.198729 2.577046
H 0.898788 1.341003 -0.040555
H 4.165271 -1.003547 -1.744795
H 5.005014 1.018408 -3.004678
H -1.305022 -2.631008 -1.305266
H -1.756006 -1.021336 -2.003246
H 2.909249 5.329628 -2.010497
H 1.893937 4.554826 -3.337293


