%chk=000274715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274715

0 1
Cl 0.740887 3.766479 -0.556471
S -4.964910 0.056389 2.818257
F -3.896780 -0.726708 3.681517
O -0.335362 2.019018 -2.461084
O -2.375230 -0.689186 -3.555649
O -4.589436 1.427334 2.985827
O -6.214662 -0.473011 3.268007
N 4.104896 -0.041500 0.267264
N 5.065804 -1.382589 2.152014
N 6.402396 -0.797441 0.186144
N 5.488130 0.268500 -1.701803
N 7.248741 -2.239252 1.874970
N -2.468174 0.580091 -1.622783
C 3.877144 -0.674718 1.670870
C 3.560324 0.475758 2.636468
C 2.718309 -1.675404 1.568982
C 2.961536 0.446321 -0.464656
C 5.345031 -0.203003 -0.379168
C 6.176848 -1.446637 1.439485
C 2.477070 1.738437 -0.184982
C 2.342079 -0.355361 -1.440293
C 1.367284 2.208242 -0.880074
C 1.231243 0.119515 -2.140267
C 0.748960 1.401388 -1.858695
C -1.036264 1.300822 -3.494026
C -3.388419 -0.203165 -0.856447
C -2.017679 0.277893 -2.912939
C -4.592267 -0.492144 1.222727
C -3.692429 0.239424 0.446428
C -3.990209 -1.373873 -1.362903
C -5.195693 -1.648591 0.726132
C -4.888235 -2.084532 -0.568985
H 3.551494 0.095895 3.670173
H 4.323195 1.261646 2.601290
H 2.583905 0.927757 2.443882
H 2.595145 -2.194623 2.532414
H 1.766430 -1.196814 1.325405
H 2.916749 -2.456341 0.825674
H 2.963776 2.362986 0.569081
H 2.735476 -1.352999 -1.653336
H 0.755623 -0.513549 -2.888791
H 6.441065 0.253183 -2.062209
H 4.976702 1.101763 -1.961433
H 7.260467 -2.486635 2.855692
H 8.154537 -2.043056 1.470698
H -0.341462 0.822688 -4.209712
H -1.579583 2.122371 -4.011609
H -2.084766 1.418631 -1.161764
H -3.236985 1.152787 0.846105
H -3.754347 -1.723651 -2.377887
H -5.911187 -2.211247 1.335547
H -5.356767 -2.989086 -0.962284


%chk=000274715-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274715

0 1
Cl 0.809663 3.818124 -0.556293
S -5.187624 0.214372 2.775004
F -3.984104 -0.826260 3.732133
O -0.402118 1.900891 -2.446598
O -2.482950 -0.822918 -3.738994
O -4.669459 1.729275 2.915545
O -6.647065 -0.248588 3.257540
N 4.159990 -0.160067 0.263129
N 5.160633 -1.700590 1.931808
N 6.546646 -0.469069 0.321921
N 5.600777 0.884695 -1.319822
N 7.441034 -2.167091 1.645834
N -2.560352 0.423773 -1.730878
C 4.043785 -0.781744 1.683034
C 4.068480 0.374830 2.721080
C 2.730540 -1.580585 1.782424
C 3.006280 0.337689 -0.431311
C 5.447754 0.074148 -0.212255
C 6.311903 -1.434362 1.327295
C 2.532431 1.657652 -0.192003
C 2.319488 -0.478173 -1.363490
C 1.402443 2.132462 -0.875953
C 1.181107 0.001847 -2.044034
C 0.714837 1.318936 -1.812143
C -1.057950 1.148010 -3.525038
C -3.536001 -0.271645 -0.973450
C -2.095668 0.131590 -3.006726
C -4.796341 -0.461917 1.072660
C -3.829965 0.221099 0.325748
C -4.217077 -1.423352 -1.460539
C -5.496576 -1.597618 0.638217
C -5.183013 -2.065715 -0.658261
H 4.055770 -0.056498 3.736793
H 4.993161 0.969136 2.611164
H 3.189910 1.037482 2.613557
H 2.697449 -2.044037 2.781799
H 1.839150 -0.941578 1.656585
H 2.714936 -2.390610 1.033813
H 3.049779 2.303544 0.523121
H 2.681766 -1.494330 -1.544515
H 0.661065 -0.660102 -2.742858
H 6.544644 0.980375 -1.685914
H 4.828875 1.406367 -1.724832
H 7.382751 -2.879371 2.367458
H 8.293535 -2.008787 1.117678
H -0.335240 0.626237 -4.175497
H -1.578326 1.916214 -4.122545
H -2.117451 1.242259 -1.294081
H -3.332086 1.108222 0.734141
H -3.982792 -1.793591 -2.460354
H -6.247818 -2.082537 1.267672
H -5.700203 -2.947893 -1.047965


