%chk=000274206.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274206

0 1
Cl 8.243600 -1.711170 1.334631
Cl 6.791458 3.591320 -3.109130
S -3.653315 -0.236943 -2.031586
F 2.484727 0.064053 3.171003
O -4.947936 0.404826 -2.063130
O -2.824854 -0.299685 -3.217812
N 5.687193 0.988066 -0.231667
N -2.642212 0.588097 -0.902356
N -0.663603 1.380294 0.881841
C 4.374709 1.027231 0.248127
C 6.794798 0.419591 0.569714
C 6.046546 1.521779 -1.565189
C 4.061663 0.504305 1.527588
C 3.331469 1.589428 -0.536345
C 6.882475 -1.095986 0.354178
C 6.339534 3.024259 -1.476645
C 1.688803 1.116944 1.213692
C -3.816637 -1.808531 -1.351940
C 2.743173 0.568056 1.963283
C 2.029401 1.624336 -0.059031
C -3.026846 1.114952 0.347771
C -2.022076 1.471526 1.306188
C -4.867890 -2.096324 -0.474519
C -2.897006 -2.811120 -1.686484
C 0.308517 1.164331 1.717542
C -4.071545 -4.377066 -0.252665
C -4.997033 -3.371886 0.075525
C -3.019582 -4.087631 -1.141760
C -4.383319 1.278867 0.689768
C -2.413054 1.963778 2.561902
C -4.740164 1.761322 1.947637
C -3.762555 2.100732 2.887702
C -4.194978 -5.745053 0.328287
H 6.646672 0.648624 1.653674
H 7.756453 0.908132 0.287400
H 5.220678 1.331134 -2.294116
H 6.932876 0.975782 -1.964608
H 4.826490 0.065577 2.164304
H 3.539516 1.993549 -1.524759
H 7.071298 -1.361251 -0.702493
H 5.959672 -1.617669 0.675889
H 7.175231 3.251343 -0.789198
H 5.456615 3.602769 -1.140455
H 1.236342 2.058625 -0.679641
H -1.649405 0.754971 -1.154122
H -5.600050 -1.321204 -0.220399
H -2.081491 -2.594634 -2.386793
H 0.193477 1.009412 2.803031
H -5.817239 -3.585940 0.758346
H -2.302034 -4.862448 -1.405348
H -5.170643 1.081952 -0.046285
H -1.653951 2.255265 3.287617
H -5.795199 1.885327 2.193007
H -4.050755 2.481075 3.864269
H -4.322632 -6.504145 -0.458787
H -3.293814 -6.021900 0.896707
H -5.048271 -5.847645 1.012442


%chk=000274206-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274206

0 1
Cl 9.246468 1.759831 1.700419
Cl 5.670495 0.459608 -4.541265
S -2.492377 -0.640391 -0.833294
F 3.201311 2.632416 3.425756
O -3.375593 0.713604 -1.062665
O -1.050060 -0.880364 -1.574177
N 5.748319 1.214764 -0.462573
N -2.101835 -0.939729 1.143329
N -0.325321 0.955632 1.926223
C 4.531159 1.290711 0.233256
C 6.976657 1.840259 0.062887
C 5.858896 0.503742 -1.751784
C 4.453348 1.928183 1.510759
C 3.322115 0.737507 -0.310818
C 7.692592 0.903970 1.055653
C 5.462245 1.416241 -2.928279
C 2.014373 1.449123 1.663857
C -3.602709 -2.097369 -1.255230
C 3.222529 1.990135 2.166142
C 2.112866 0.817017 0.386422
C -2.561450 0.103869 1.978548
C -1.616168 1.078857 2.472611
C -4.988257 -1.882792 -1.297348
C -3.004655 -3.338414 -1.529110
C 0.753416 1.546588 2.391523
C -5.263800 -4.259025 -1.903344
C -5.814929 -2.981334 -1.626562
C -3.851727 -4.418206 -1.855206
C -3.922823 0.172381 2.372598
C -2.066870 2.077742 3.378438
C -4.351138 1.177699 3.258652
C -3.421322 2.126214 3.763153
C -6.156232 -5.435619 -2.254574
H 6.749740 2.806024 0.547546
H 7.656516 2.061890 -0.778245
H 5.237056 -0.407931 -1.753257
H 6.903556 0.173212 -1.888920
H 5.321364 2.368213 2.006205
H 3.320708 0.253259 -1.290501
H 8.035068 -0.025905 0.577742
H 7.080966 0.677664 1.940695
H 6.116730 2.296635 -3.011952
H 4.407334 1.722927 -2.890215
H 1.197437 0.404089 -0.050944
H -1.059256 -0.837384 1.064929
H -5.398568 -0.885601 -1.106622
H -1.915894 -3.447229 -1.507730
H 0.769842 2.124108 3.334589
H -6.900616 -2.839599 -1.672628
H -3.411289 -5.397510 -2.076713
H -4.620728 -0.579056 1.989022
H -1.370281 2.837222 3.751102
H -5.402101 1.229137 3.561887
H -3.762386 2.909223 4.449473
H -5.902379 -5.846203 -3.249509
H -6.037982 -6.258101 -1.524568
H -7.221060 -5.148535 -2.269580


