%chk=000106280.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000106280

1 1
S 1.816276 -2.518867 -0.315524
S -2.751264 2.632045 -0.491855
O 1.535941 -2.395208 -1.962747
O -2.337566 3.052181 1.071778
O 2.723881 -3.611653 -0.170829
O 0.491653 -2.539701 0.280794
O -1.589252 2.794460 -1.302777
O -4.006154 3.267767 -0.762166
O 6.448130 1.668770 0.111240
O 6.596787 -0.404618 -0.515187
N 5.985245 0.572629 -0.132114
N -6.025961 -1.217649 0.225256
N -7.087123 -1.550537 0.293726
C 1.775122 0.109640 0.414171
C 2.551215 -0.993347 0.004436
C -2.028655 -0.003191 -0.043507
C -3.073100 0.933090 -0.202250
C 0.326571 -0.089317 0.645530
C -0.623470 0.361803 -0.186527
C 3.928421 -0.844370 -0.170060
C 2.368239 1.357357 0.631830
C 4.515678 0.409270 0.056517
C -2.360667 -1.365865 0.219022
C -4.399907 0.546846 -0.111523
C 3.745737 1.513698 0.451583
C -4.713870 -0.814583 0.142151
C -3.664559 -1.780585 0.311847
H 0.089468 -0.668759 1.555198
H -0.373677 1.001252 -1.059012
H 4.567073 -1.692975 -0.476157
H 1.760318 2.213157 0.938867
H -1.525937 -2.100943 0.325843
H -5.209578 1.289952 -0.239140
H 4.231283 2.488160 0.615968
H -3.910419 -2.831060 0.508073
H 1.791473 -3.160349 -2.511887
H -2.406753 3.992399 1.323430


%chk=000106280-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000106280

1 1
S 2.280352 -2.905845 0.116721
S -2.831565 2.902230 -0.018294
O 1.792903 -3.066587 -1.665001
O -2.245785 2.935894 1.728981
O 3.595474 -3.777005 0.438154
O 0.925896 -3.070147 0.993639
O -1.595130 3.245643 -0.996321
O -4.258836 3.638073 -0.172665
O 6.294228 2.111795 -0.043998
O 6.792104 -0.119724 0.052836
N 5.971330 0.867488 -0.013136
N -6.186692 -1.029354 0.021366
N -7.311747 -1.327064 0.016691
C 1.744247 -0.072169 -0.147942
C 2.753195 -1.073064 -0.042002
C -2.104214 0.059513 0.029912
C -3.169423 1.020982 0.035616
C 0.326009 -0.419340 -0.214210
C -0.709839 0.449964 0.065802
C 4.122048 -0.813683 0.004103
C 2.204258 1.279959 -0.212793
C 4.510502 0.541823 -0.058213
C -2.518151 -1.324524 0.035502
C -4.519373 0.710412 0.030909
C 3.574378 1.589881 -0.169865
C -4.863607 -0.676881 0.023895
C -3.857120 -1.700312 0.032969
H 0.095357 -1.443289 -0.523492
H -0.489286 1.484565 0.342716
H 4.870819 -1.608197 0.099279
H 1.479739 2.089221 -0.343916
H -1.758189 -2.109314 0.091659
H -5.275755 1.505249 0.020640
H 3.932899 2.621147 -0.228041
H -4.143244 -2.756038 0.052519
H 1.872552 -4.026071 -1.942424
H -2.139735 3.885668 2.032402


