%chk=000217562.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217562

0 1
Cl 6.372136 1.847360 -0.801899
S -6.189089 -0.090830 -1.558501
O 1.594731 0.517669 -0.181207
N -4.462388 -0.210850 0.494615
C -3.251330 0.585110 0.107433
C -5.599218 0.652815 0.942777
C -2.010387 -0.312544 0.256265
C -4.952880 -1.077950 -0.588702
C -6.420494 1.157321 -0.249782
C -0.732622 0.477117 -0.036951
C 0.501474 -0.407481 0.124946
C 2.879936 0.046356 -0.128775
C 3.836100 1.036680 -0.444824
C 3.255819 -1.265113 0.197458
C 5.172018 0.661912 -0.420606
C 4.617102 -1.589516 0.206859
C 5.589461 -0.635572 -0.100408
H -3.314334 0.997551 -0.923111
H -3.161055 1.458159 0.790042
H -5.224605 1.492026 1.563815
H -6.232887 0.026907 1.613955
H -2.087758 -1.185246 -0.420961
H -1.983347 -0.732763 1.282799
H -4.156405 -1.436315 -1.265740
H -5.469152 -1.957540 -0.150792
H -7.493359 1.249410 -0.010955
H -6.075290 2.138739 -0.616675
H -0.646628 1.355945 0.635284
H -0.753986 0.898920 -1.063229
H 0.632812 -0.777880 1.155303
H 0.532848 -1.239428 -0.597971
H 3.515365 2.046133 -0.694444
H 2.520239 -2.023441 0.439781
H 4.922340 -2.606364 0.459000
H 6.646332 -0.891295 -0.092102


%chk=000217562-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217562

0 1
Cl 6.587543 1.790408 -0.973214
S -6.049590 -0.036151 -1.781484
O 1.627187 0.640213 -0.182366
N -4.539269 -0.268570 0.536812
C -3.318847 0.537564 0.241517
C -5.726124 0.536272 0.916366
C -2.026238 -0.293552 0.366903
C -4.957357 -1.144084 -0.532197
C -6.335233 1.197518 -0.368202
C -0.773876 0.551860 0.041279
C 0.513759 -0.264710 0.164369
C 2.927776 0.121769 -0.157905
C 3.945490 1.044875 -0.513611
C 3.257604 -1.213642 0.187861
C 5.276074 0.604066 -0.514528
C 4.613355 -1.614590 0.173619
C 5.643973 -0.715482 -0.177063
H -3.375853 0.991938 -0.775534
H -3.283507 1.366214 0.973310
H -5.448189 1.291901 1.670711
H -6.477136 -0.141109 1.362677
H -2.072418 -1.164297 -0.318055
H -1.967235 -0.701280 1.394685
H -4.117711 -1.562604 -1.103007
H -5.634103 -1.932716 -0.173117
H -7.416613 1.374039 -0.257339
H -5.826511 2.142173 -0.620621
H -0.710648 1.421026 0.723953
H -0.841708 0.954898 -0.987359
H 0.650500 -0.643175 1.198871
H 0.506174 -1.128354 -0.533252
H 3.673480 2.069640 -0.777699
H 2.484092 -1.934802 0.464517
H 4.871067 -2.645225 0.440235
H 6.691591 -1.026029 -0.188437


