%chk=000179959.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179959

0 1
S 0.102290 -0.526453 0.363926
O 5.748937 0.493954 1.865824
C -2.563672 0.081742 -0.090189
C -1.192960 0.195403 -0.562663
C -0.695330 0.793616 -1.685274
C -3.574295 -0.335382 -0.975579
C -2.889105 0.385142 1.243253
C 1.321525 0.001855 -0.783186
C 0.735542 0.686730 -1.812639
C -4.892008 -0.448915 -0.527870
C -4.210431 0.269331 1.681926
C -5.212534 -0.147609 0.800030
C 5.183521 -0.925896 -0.045469
C 2.656306 -0.312032 -0.537788
C 5.988344 0.280077 0.471999
C 3.811769 -0.593619 -0.313740
H -1.294254 1.314944 -2.420545
H -3.324276 -0.575354 -2.008037
H -2.115448 0.718688 1.934393
H 1.271173 1.115787 -2.648876
H -5.671643 -0.774172 -1.215172
H -4.459653 0.506025 2.715444
H -6.240508 -0.237434 1.146255
H 5.236619 -1.747838 0.711763
H 5.664902 -1.336914 -0.963708
H 7.077378 0.084189 0.439178
H 5.755694 1.204699 -0.085879
H 4.799516 0.679233 2.025623


%chk=000179959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179959

0 1
S 0.119381 -0.530508 0.620987
O 5.581408 1.126881 1.561487
C -2.609310 0.024067 -0.045220
C -1.208106 0.025733 -0.485404
C -0.672884 0.412722 -1.716754
C -3.661003 0.192483 -0.994198
C -2.962926 -0.141069 1.325115
C 1.368806 -0.196605 -0.666478
C 0.747664 0.291999 -1.819734
C -5.008603 0.203378 -0.584249
C -4.312503 -0.136085 1.731625
C -5.344696 0.038931 0.780671
C 5.356462 -0.898308 0.104114
C 2.735573 -0.439072 -0.416756
C 6.115018 0.429094 0.393099
C 3.931226 -0.675027 -0.184912
H -1.290937 0.798582 -2.530466
H -3.423302 0.298287 -2.057987
H -2.174708 -0.261462 2.078112
H 1.317868 0.558200 -2.712472
H -5.800312 0.331985 -1.330823
H -4.559126 -0.263559 2.791408
H -6.393422 0.044482 1.096707
H 5.449454 -1.557875 0.988622
H 5.843319 -1.417212 -0.746113
H 7.164166 0.205220 0.646684
H 6.090687 1.075458 -0.509062
H 4.618206 1.309078 1.404996


