%chk=000187476.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187476

0 1
S -1.648937 -2.340578 -1.755032
S 2.072293 -1.846738 0.695289
S -1.100944 -3.621188 0.024013
S 0.011015 -2.290621 1.507990
O -4.166831 -1.212591 -1.149545
O 0.467904 0.272075 -0.236587
N -2.267330 -0.138324 -0.242068
N 2.743718 0.319403 -0.806720
C -2.948820 0.957092 0.503011
C 2.729038 1.574342 -1.610362
C -2.810572 0.742379 2.034046
C 3.602920 2.662530 -0.934092
C -2.364450 2.313387 0.051893
C 3.179935 1.272457 -3.055658
C -3.501018 -0.538936 2.544120
C 3.102308 3.076569 0.464468
C -2.942722 -1.085126 -0.949206
C 1.631378 -0.212184 -0.214901
H -4.017785 0.898988 0.227474
H 1.675961 1.907985 -1.612702
H -3.245523 1.629572 2.535997
H -1.733169 0.724152 2.295290
H 3.617759 3.543335 -1.605556
H 4.650744 2.300865 -0.874550
H -1.282073 2.367121 0.273772
H -2.503862 2.461625 -1.033127
H -2.867158 3.140304 0.584468
H 4.228741 0.919358 -3.082527
H 2.540335 0.500235 -3.516291
H 3.118596 2.187132 -3.671884
H -1.234720 -0.147817 -0.227630
H 3.635487 -0.177955 -0.726964
H -3.061568 -1.441452 2.082187
H -3.392874 -0.635619 3.639562
H -4.580768 -0.532894 2.306560
H 3.074893 2.212409 1.152343
H 3.761911 3.842735 0.909631
H 2.080788 3.496070 0.412488


%chk=000187476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187476

0 1
S -1.696675 -2.336052 -1.733507
S 2.107759 -1.856351 0.635380
S -1.089288 -3.618315 0.024516
S 0.065435 -2.313434 1.500084
O -4.215137 -1.243814 -1.068120
O 0.540627 0.300458 -0.263872
N -2.319898 -0.124189 -0.220857
N 2.798895 0.308970 -0.854627
C -3.015193 0.961974 0.525192
C 2.795898 1.571377 -1.647433
C -2.874575 0.751514 2.056923
C 3.639792 2.662904 -0.939000
C -2.446240 2.324525 0.073245
C 3.291792 1.282978 -3.080496
C -3.534520 -0.545031 2.568325
C 3.103249 3.053714 0.452970
C -2.988853 -1.089105 -0.900181
C 1.688436 -0.208791 -0.254315
H -4.084036 0.891618 0.250676
H 1.740316 1.895919 -1.678419
H -3.332473 1.628602 2.556646
H -1.797740 0.760004 2.319761
H 3.656827 3.551779 -1.599729
H 4.690806 2.314636 -0.860507
H -1.363974 2.388250 0.291177
H -2.590760 2.471897 -1.011324
H -2.955913 3.145789 0.608159
H 4.343039 0.935935 -3.078619
H 2.670598 0.511411 -3.566712
H 3.244315 2.202388 -3.690638
H -1.283989 -0.105035 -0.226999
H 3.684310 -0.201080 -0.785233
H -3.075427 -1.436737 2.104954
H -3.421106 -0.639422 3.663518
H -4.614712 -0.563956 2.333392
H 3.083916 2.184060 1.134181
H 3.736115 3.831736 0.915825
H 2.072982 3.448971 0.384863


