%chk=000180632.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180632

0 1
S 3.099734 -0.419358 -0.116551
O 1.804661 0.270741 -0.965228
O 0.137130 2.474456 0.127089
O 4.126718 -0.106433 -1.385393
O 3.458956 0.427896 0.964999
O 2.893132 -1.820508 -0.002567
C -2.120114 -0.327130 0.362907
C -3.541523 -0.555439 0.800933
C -1.566708 0.949178 0.420052
C -0.230020 1.164618 0.013718
C 0.529174 0.071747 -0.453235
C -1.347535 -1.412706 -0.105840
C -0.036530 -1.214131 -0.514445
C -4.482076 -0.608491 -0.370365
C 1.513242 2.845936 -0.149366
C -5.769371 -0.280480 -0.285803
H -3.619893 -1.510155 1.370124
H -3.858238 0.228202 1.523586
H -2.143563 1.805642 0.769670
H -1.784578 -2.408642 -0.148503
H 0.570117 -2.049947 -0.874289
H -4.034729 -0.950252 -1.306256
H 1.788737 2.556606 -1.168104
H 2.178307 2.395715 0.598217
H 1.471884 3.936457 -0.037174
H -6.447325 -0.333254 -1.125663
H -6.248760 0.065705 0.617760
H 3.723268 -0.131673 -2.276473


%chk=000180632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180632

0 1
S 3.543866 -0.241750 0.099285
O 1.631896 0.140941 -1.143663
O 0.073274 2.321749 0.163296
O 4.437119 0.027215 -1.510305
O 3.944002 1.021264 1.048483
O 3.898645 -1.731164 0.639306
C -2.240022 -0.501157 0.372383
C -3.660119 -0.751402 0.860336
C -1.661751 0.775166 0.465897
C -0.346727 1.029720 -0.005148
C 0.419905 -0.053340 -0.633469
C -1.486709 -1.575349 -0.223715
C -0.199861 -1.357490 -0.699731
C -4.663750 -0.666415 -0.286466
C 1.427287 2.819350 -0.193100
C -5.725451 0.175403 -0.316832
H -3.716126 -1.761989 1.312712
H -3.937437 -0.022767 1.642358
H -2.209747 1.609959 0.913843
H -1.935827 -2.572951 -0.284796
H 0.395700 -2.161810 -1.143681
H -4.484248 -1.345605 -1.132874
H 1.646286 2.615400 -1.252752
H 2.199511 2.349820 0.443647
H 1.362599 3.898944 0.004126
H -6.419319 0.187755 -1.164554
H -5.936079 0.872008 0.504070
H 3.707179 -0.037205 -2.194857


