%chk=000207590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207590

0 1
S 0.240752 -1.333630 0.696117
O 1.187698 -1.505541 2.102571
O -1.030076 -1.810210 1.182745
O 0.928057 -2.049339 -0.343542
C 2.841052 0.418119 0.813236
C 1.517965 1.071328 0.529313
C 3.459072 -0.154618 -0.473511
C 0.307700 0.358980 0.424033
C -0.867803 1.045988 0.058911
C 4.880566 -0.674906 -0.222062
C 1.518645 2.466830 0.336442
C -0.853534 2.433523 -0.122772
C -2.153580 0.344411 -0.188757
C 0.342023 3.142826 0.026711
C 5.491035 -1.260666 -1.493209
C -2.397261 -0.226086 -1.447762
C -3.139264 0.299524 0.807685
C -3.623468 -0.844759 -1.703061
C -4.363148 -0.322975 0.544877
C -4.606140 -0.893869 -0.708293
H 3.542620 1.148244 1.269625
H 2.763189 -0.383326 1.586175
H 3.471140 0.616349 -1.266473
H 2.822713 -0.983627 -0.861501
H 5.524085 0.139627 0.162218
H 4.860029 -1.449351 0.571033
H 2.453349 3.019946 0.423939
H -1.772349 2.954969 -0.389348
H 0.352275 4.225700 -0.110877
H 5.563568 -0.513649 -2.291134
H 4.888724 -2.093214 -1.878915
H 6.499639 -1.645787 -1.307721
H -1.632402 -0.191099 -2.222724
H -2.943180 0.729206 1.788885
H -3.810556 -1.295462 -2.676534
H -5.123566 -0.371528 1.322722
H 0.832086 -2.129443 2.754428
H -5.557956 -1.383586 -0.907971


%chk=000207590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207590

0 1
S 0.235876 -1.524866 0.932354
O 1.150537 -1.445756 2.575553
O -1.228300 -2.079627 1.340893
O 1.131524 -2.365063 -0.120144
C 2.905068 0.285700 0.782743
C 1.563007 0.982610 0.617967
C 3.552479 -0.046620 -0.592955
C 0.299363 0.346140 0.526266
C -0.923287 0.995316 0.211107
C 4.940306 -0.706281 -0.431522
C 1.550425 2.396337 0.469324
C -0.862596 2.411786 0.095683
C -2.217944 0.322508 -0.113480
C 0.354188 3.104833 0.243444
C 5.599233 -1.031426 -1.789089
C -2.282059 -0.658219 -1.138550
C -3.417167 0.731988 0.523934
C -3.518354 -1.230115 -1.503038
C -4.653171 0.155118 0.162051
C -4.707847 -0.827926 -0.853015
H 3.582544 0.958470 1.342888
H 2.816715 -0.639808 1.374319
H 3.648351 0.879730 -1.195521
H 2.882371 -0.731514 -1.146408
H 5.603411 -0.035982 0.153874
H 4.830371 -1.636685 0.160306
H 2.504363 2.930745 0.542550
H -1.782861 2.948397 -0.156759
H 0.372894 4.195920 0.151927
H 5.739557 -0.114842 -2.393145
H 4.970609 -1.727393 -2.375120
H 6.590093 -1.502641 -1.653922
H -1.367424 -0.963695 -1.660689
H -3.374687 1.478611 1.325398
H -3.552549 -1.987516 -2.293532
H -5.569799 0.466766 0.674824
H 0.715519 -2.159434 3.128834
H -5.667058 -1.276667 -1.133853


