%chk=000184789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184789

0 1
Cl 3.122324 1.542993 -1.963808
F 2.814374 -1.845727 3.403959
F 3.629101 -2.553442 1.590381
F 4.604168 -1.011754 2.658866
O -2.306091 1.836652 0.605802
O -2.295722 1.913359 -1.657625
O -0.868341 -3.431118 0.162566
N 0.590536 2.563420 -0.740104
N -5.315296 1.882012 2.002998
C -0.871729 4.598800 -0.985826
C -0.645586 3.219026 -0.296465
C 0.148688 5.608405 -0.459062
C -0.833660 4.510194 -2.510551
C -1.824652 2.277809 -0.613844
C 1.229787 1.575582 0.000172
C -3.365959 0.820523 0.611700
C 2.457015 1.024065 -0.463722
C 0.708574 1.084778 1.223267
C -2.734618 -0.411975 1.222036
C 2.619641 -0.389702 1.488917
C 3.146145 0.065826 0.269715
C 1.396516 0.123927 1.952533
C -2.084501 -1.303847 0.355988
C -2.768070 -0.649997 2.599014
C 3.382451 -1.416007 2.264432
C -1.475031 -2.432963 0.910793
C -4.454428 1.409413 1.397631
C -2.159116 -1.799955 3.125077
C -1.503067 -2.701028 2.292517
C -0.274160 -3.107621 -1.067153
C 0.502634 -1.959840 -1.250949
C -0.434755 -4.086708 -2.056029
C 1.141842 -1.793509 -2.482704
C 0.219802 -3.896248 -3.274680
C 1.000746 -2.753812 -3.490678
H -1.897353 4.939519 -0.679702
H -0.614639 3.380705 0.822615
H 1.181608 5.300906 -0.665229
H 0.063431 5.754699 0.624077
H 0.007912 6.590443 -0.928922
H 0.175868 4.341983 -2.901332
H -1.194309 5.441558 -2.965805
H -1.476393 3.700367 -2.890951
H 0.916032 2.802852 -1.676968
H -3.708572 0.642308 -0.448194
H -0.254223 1.444999 1.595881
H 4.094549 -0.328701 -0.111050
H 0.964481 -0.231216 2.893076
H -2.056278 -1.129711 -0.719485
H -3.264029 0.048142 3.272853
H -2.197634 -1.984997 4.200111
H -1.019484 -3.598126 2.678227
H 0.622011 -1.229197 -0.453013
H -1.044671 -4.966109 -1.862209
H 1.758642 -0.909500 -2.652967
H 0.118213 -4.642621 -4.062682
H 1.503174 -2.614732 -4.445898


%chk=000184789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184789

0 1
Cl 3.348599 1.877079 -2.051880
F 3.131588 -2.140543 2.976416
F 4.746283 -2.001198 1.375713
F 4.775498 -0.595844 3.149337
O -2.429177 1.948106 0.643116
O -1.765822 1.417819 -1.538400
O -1.085246 -3.491367 0.182417
N 0.784959 2.664155 -0.638236
N -5.648478 1.911884 1.742549
C -0.899553 4.492777 -0.945679
C -0.528596 3.149289 -0.228366
C -0.037264 5.646911 -0.381275
C -0.798193 4.411398 -2.488909
C -1.612923 2.081164 -0.491540
C 1.498640 1.696164 0.048354
C -3.507259 0.867803 0.555291
C 2.750223 1.218209 -0.449194
C 1.044594 1.124684 1.278960
C -2.984012 -0.410616 1.189516
C 3.057148 -0.260963 1.446655
C 3.526512 0.270319 0.219485
C 1.814366 0.172393 1.965552
C -2.292150 -1.325028 0.357652
C -3.135852 -0.666374 2.573476
C 3.900025 -1.229023 2.209661
C -1.736540 -2.491441 0.929508
C -4.684517 1.446770 1.218215
C -2.585698 -1.846116 3.123827
C -1.882173 -2.758694 2.311680
C -0.467683 -3.195745 -1.068771
C 0.382808 -2.080327 -1.240554
C -0.659548 -4.141565 -2.096918
C 1.035561 -1.906941 -2.481243
C 0.006384 -3.958898 -3.329511
C 0.850297 -2.840967 -3.527593
H -1.957524 4.690290 -0.679994
H -0.530441 3.346217 0.859447
H 1.038901 5.459650 -0.549641
H -0.195104 5.777498 0.704867
H -0.298914 6.597543 -0.879494
H 0.254297 4.374577 -2.832397
H -1.240901 5.318954 -2.935904
H -1.327376 3.532789 -2.895810
H 1.114774 2.914776 -1.572484
H -3.713075 0.713992 -0.521614
H 0.076551 1.420096 1.692582
H 4.476343 -0.063620 -0.206998
H 1.436924 -0.251198 2.901121
H -2.185121 -1.123502 -0.713110
H -3.682274 0.038898 3.208748
H -2.703741 -2.056498 4.191769
H -1.447520 -3.675644 2.720205
H 0.541487 -1.369963 -0.423036
H -1.314681 -4.999346 -1.918383
H 1.696535 -1.044958 -2.623021
H -0.136524 -4.689354 -4.133193
H 1.362480 -2.701369 -4.485371


