%chk=000179266.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179266

0 1
Cl -3.586591 2.460926 -2.854741
S 2.127617 -0.454825 1.385447
S 4.500757 1.282873 -0.234451
P 2.531474 0.617827 -0.380772
O -2.214133 0.300551 1.635176
O 1.653433 2.000567 -0.351625
O -1.029860 -1.001078 3.099711
O 2.210170 -0.223729 -1.566024
N -0.476299 -0.946508 0.776539
C -1.032136 -0.188382 -0.300991
C 0.805460 -1.615521 0.763461
C -2.119588 0.548391 0.258551
C -1.169478 -0.609414 1.979703
C -0.741133 -0.093949 -1.656010
C -2.936956 1.377668 -0.485195
C -1.557331 0.745143 -2.431954
C -2.617027 1.449322 -1.851680
C 5.415512 -0.024698 -1.168341
C 1.747935 2.942378 0.755322
C 5.804764 -1.141616 -0.233739
C 0.673486 2.640712 1.779201
H 0.815687 -2.465750 1.487802
H 1.055087 -1.993495 -0.258794
H 0.105242 -0.625209 -2.109615
H -3.765298 1.931012 -0.047177
H -1.350553 0.851002 -3.499410
H 4.818368 -0.388298 -2.031816
H 6.300517 0.498333 -1.585119
H 2.761260 2.981154 1.189508
H 1.547339 3.894510 0.214968
H 6.312065 -0.778804 0.671996
H 4.944703 -1.738746 0.101246
H 6.496389 -1.841628 -0.727126
H 0.409230 3.538664 2.353134
H -0.250546 2.290771 1.293021
H 0.967834 1.871749 2.505593


%chk=000179266-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179266

0 1
Cl -4.381884 2.187410 -2.497284
S 2.103901 -0.244064 1.484749
S 5.012961 1.302204 -0.191547
P 2.779710 0.827268 -0.464226
O -2.615204 -0.754657 1.538046
O 2.025194 2.374896 -0.549740
O -1.067268 -2.037049 2.804224
O 2.404378 -0.064355 -1.737433
N -0.508366 -1.064689 0.687833
C -1.213217 -0.259764 -0.243732
C 0.870195 -1.472951 0.643026
C -2.511624 -0.084849 0.294232
C -1.333528 -1.371900 1.795196
C -0.858830 0.304796 -1.479829
C -3.511742 0.647256 -0.348368
C -1.853748 1.056085 -2.154999
C -3.138499 1.212064 -1.590130
C 5.663000 -0.321965 -0.978265
C 2.174570 3.391695 0.543126
C 5.763407 -1.475828 0.023422
C 0.910466 3.443485 1.400446
H 0.998482 -2.395325 1.228420
H 1.218467 -1.595034 -0.395630
H 0.141340 0.187297 -1.910240
H -4.508872 0.771425 0.077962
H -1.622426 1.519974 -3.117329
H 4.993667 -0.548334 -1.825617
H 6.647819 -0.021616 -1.375408
H 3.077546 3.173993 1.147964
H 2.338913 4.333985 -0.005507
H 6.426955 -1.220877 0.867310
H 4.774771 -1.743270 0.434725
H 6.177956 -2.368506 -0.483371
H 0.983390 4.286375 2.113472
H 0.022827 3.604714 0.765712
H 0.772694 2.512013 1.974588


