%chk=000279531.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279531

0 1
Cl 0.668585 4.008692 -1.729116
Cl -1.990364 -2.029613 -1.105178
S -4.784404 -2.358707 0.579947
F -5.556941 -2.681858 -0.757953
O -3.817587 -3.402439 0.686109
O -5.836626 -2.170980 1.535960
N 3.196458 -0.071210 0.075124
N 4.139483 -2.245760 -0.735042
N 5.245919 -0.945590 1.019407
N 4.227707 0.911693 2.041827
N 6.245435 -2.900690 0.109871
C 3.068715 -1.264723 -0.920252
C 2.075912 0.828720 0.212367
C 1.724001 -1.960936 -0.677983
C 3.167275 -0.674189 -2.333849
C -1.338114 3.458543 0.509613
C -0.134667 2.564899 0.418853
C 4.240873 -0.061779 1.018796
C -2.411776 3.094277 -0.532197
C 1.934493 1.881112 -0.705571
C 1.137376 0.657606 1.247281
C 0.830101 2.725401 -0.586205
C 0.046618 1.519395 1.341295
C 5.141785 -2.034640 0.100391
C -2.990020 1.731079 -0.279685
C -2.332814 0.589254 -0.760442
C -4.187142 1.583354 0.446155
C -4.056550 -0.839233 0.211136
C -2.868490 -0.675416 -0.504873
C -4.709677 0.315870 0.681273
H 1.656331 -2.863025 -1.306220
H 1.619194 -2.304473 0.358003
H 0.865619 -1.326853 -0.917153
H 4.069656 -0.064023 -2.458682
H 3.241561 -1.491449 -3.068058
H 2.297030 -0.068468 -2.597571
H -1.778715 3.417443 1.528232
H -1.039435 4.520952 0.367395
H -1.977117 3.146648 -1.555436
H -3.207151 3.869059 -0.520908
H 2.671634 2.030870 -1.497532
H 1.266889 -0.151100 1.969737
H -0.684095 1.373229 2.139032
H 5.083855 0.966055 2.591766
H 3.840970 1.819756 1.819386
H -1.400599 0.689720 -1.321317
H -4.706894 2.462952 0.825129
H -5.645272 0.213623 1.251103
H 6.108973 -3.809566 -0.313768
H 6.817102 -2.900082 0.944099


%chk=000279531-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279531

0 1
Cl 0.677564 4.069698 -1.741168
Cl -2.437404 -2.145659 -1.348271
S -5.109488 -2.417846 0.751703
F -5.783057 -2.809365 -0.929290
O -4.090356 -3.597318 1.121542
O -6.375410 -2.094666 1.689397
N 3.218836 -0.146048 0.094654
N 4.085232 -2.384840 -0.531792
N 5.376368 -0.856584 0.891683
N 4.506187 1.191407 1.583094
N 6.025337 -3.076023 0.589465
C 3.240607 -1.270483 -0.977680
C 2.104140 0.749665 0.221394
C 1.809003 -1.802391 -1.179252
C 3.810360 -0.680114 -2.298129
C -1.368918 3.422439 0.579668
C -0.153817 2.521216 0.460676
C 4.381772 0.035137 0.838415
C -2.502148 3.086229 -0.453694
C 1.944561 1.836768 -0.679863
C 1.144781 0.564036 1.249988
C 0.829484 2.682803 -0.545993
C 0.044529 1.437552 1.359213
C 5.104926 -2.095385 0.266972
C -3.142630 1.733157 -0.207251
C -2.601622 0.563570 -0.800137
C -4.272329 1.609541 0.643598
C -4.277386 -0.790300 0.310772
C -3.164458 -0.702961 -0.547026
C -4.848285 0.351462 0.904588
H 1.858021 -2.628326 -1.907280
H 1.412076 -2.208124 -0.233685
H 1.122827 -1.028001 -1.564829
H 4.814937 -0.254452 -2.125118
H 3.903864 -1.492440 -3.039360
H 3.148613 0.099740 -2.718088
H -1.784261 3.351012 1.601579
H -1.076213 4.475338 0.412701
H -2.074988 3.136701 -1.470949
H -3.267646 3.880850 -0.381186
H 2.687510 2.012805 -1.462200
H 1.270448 -0.269812 1.947290
H -0.691645 1.281337 2.155962
H 5.334064 1.269844 2.168331
H 3.844227 1.958756 1.509859
H -1.737593 0.633085 -1.468112
H -4.711686 2.503585 1.098843
H -5.727584 0.244031 1.548072
H 5.923425 -4.003098 0.187255
H 6.750327 -2.864128 1.267932


