%chk=000191844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191844

0 1
Cl 4.837076 0.746537 0.531937
S -1.128907 2.193498 -0.457892
O -1.535295 3.285480 0.416468
O -1.237352 2.416432 -1.887365
N -0.016830 -0.622333 -0.471797
N 1.581902 -5.229327 0.547903
C 0.919507 0.406388 -0.186915
C -1.399354 -0.503420 -0.124608
C 0.497323 1.743148 -0.081203
C -1.997068 0.762832 -0.036936
C 0.478766 -1.921502 -1.016565
C 0.856833 -2.922003 0.084364
C 2.290862 0.094891 -0.004886
C -2.170693 -1.659685 0.138731
C 1.409493 2.749646 0.258286
C -3.341021 0.876401 0.342956
C 1.472012 -4.193485 -0.520487
C 3.166014 1.126735 0.305950
C -3.509058 -1.525966 0.494610
C 2.756822 2.456349 0.458003
C -4.101520 -0.259324 0.607762
H 1.348336 -1.716157 -1.684248
H -0.311970 -2.346727 -1.679553
H -0.041248 -3.195678 0.683719
H 1.552995 -2.462185 0.813129
H 2.658675 -0.926111 -0.086709
H -1.727609 -2.654877 0.091376
H 1.057969 3.784453 0.369662
H -3.794008 1.871487 0.435239
H 2.442161 -3.955432 -1.008613
H 0.805369 -4.601018 -1.314964
H -4.103352 -2.419662 0.697978
H 3.470368 3.235837 0.719156
H -5.145630 -0.168068 0.899417
H 2.218490 -4.928527 1.279816
H 1.953141 -6.094130 0.165680


%chk=000191844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191844

0 1
Cl 4.949464 0.642068 0.457093
S -1.170305 2.299688 -0.504623
O -1.634770 3.574140 0.412365
O -1.240296 2.437598 -2.133217
N -0.047252 -0.631475 -0.479761
N 1.821454 -5.201523 0.565146
C 0.900025 0.386428 -0.209506
C -1.429310 -0.503095 -0.164641
C 0.542757 1.752753 -0.031374
C -2.072482 0.753566 0.004982
C 0.450119 -1.947286 -0.966329
C 0.867568 -2.956902 0.132238
C 2.288095 0.083487 -0.062201
C -2.255234 -1.649753 0.038508
C 1.453091 2.753980 0.341194
C -3.406872 0.904033 0.414733
C 1.505977 -4.220086 -0.486877
C 3.194761 1.098332 0.277298
C -3.604524 -1.516463 0.417089
C 2.814134 2.434701 0.513192
C -4.189486 -0.246346 0.633471
H 1.304380 -1.750064 -1.639670
H -0.338910 -2.388928 -1.600678
H 0.003863 -3.271654 0.743351
H 1.583909 -2.487245 0.833854
H 2.660817 -0.933371 -0.184234
H -1.840491 -2.653656 -0.068844
H 1.088712 3.777532 0.480685
H -3.811834 1.913561 0.545327
H 2.386813 -3.912462 -1.105716
H 0.782091 -4.688446 -1.182463
H -4.200614 -2.423076 0.566651
H 3.548675 3.191777 0.795764
H -5.232560 -0.157085 0.949800
H 2.508691 -4.876895 1.252351
H 2.032745 -6.143335 0.224444


