%chk=000268542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268542

0 1
S -0.724570 -1.680698 1.102141
S -1.168352 -0.023179 2.218861
O 7.110767 0.179167 -0.634053
O -6.830149 -1.554112 -0.451305
O -0.370588 -1.402522 -1.574210
O -0.225491 3.417161 0.714124
O 1.660036 -2.322569 -1.709000
O 1.075365 1.862955 1.655877
C 3.240991 -0.631978 0.637717
C -3.483583 0.814415 0.168098
C 3.854234 0.555992 1.081645
C -4.710739 1.269818 0.667847
C 3.952133 -1.501911 -0.216034
C -3.413770 -0.412633 -0.525284
C 5.833738 0.002441 -0.161603
C -5.783751 -0.701173 -0.194095
C 5.147324 0.888955 0.682107
C -5.873743 0.514387 0.496703
C 5.246433 -1.198153 -0.614116
C -4.558442 -1.172564 -0.715361
C 1.890620 -0.921153 1.114710
C -2.279003 1.637002 0.337007
C 0.856413 -1.414396 0.409322
C -1.236374 1.331067 1.124716
C 0.839027 -1.770654 -1.010838
C -0.016676 2.147058 1.220248
C 7.826337 1.374669 -0.236625
C -8.141007 -1.194341 0.049383
H 3.296523 1.237934 1.734584
H -4.763178 2.217461 1.205283
H 3.479826 -2.427278 -0.568280
H -2.451379 -0.763107 -0.920158
H 5.599273 1.813082 1.024279
H -6.815299 0.872771 0.897642
H 5.810585 -1.859097 -1.269183
H -4.531754 -2.122969 -1.244938
H 1.724737 -0.635527 2.172415
H -2.269756 2.571443 -0.251332
H 7.961525 1.393362 0.848497
H 8.787439 1.240490 -0.750711
H 7.308064 2.266070 -0.601004
H -8.749817 -2.042902 -0.290536
H -8.127791 -1.135206 1.141464
H -8.479622 -0.260811 -0.408468
H -0.409462 -1.635465 -2.542887
H 0.588904 3.984600 0.765452


%chk=000268542-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268542

0 1
S -0.551743 -1.636913 -0.685075
S -0.707655 -0.830488 1.482361
O 7.689083 0.580416 -0.062993
O -7.620742 -1.288994 0.330865
O 0.373854 -2.759821 -2.912508
O -0.707023 3.245849 1.279224
O 2.675308 -2.544020 -2.866581
O 1.015049 1.724251 1.549464
C 3.580365 -0.480593 -0.337383
C -3.840758 0.568063 0.866804
C 4.012766 0.444817 0.666456
C -5.005040 1.368583 0.646567
C 4.576042 -1.011945 -1.221389
C -4.015979 -0.855040 0.898940
C 6.322710 0.282342 -0.090780
C -6.418943 -0.606838 0.500820
C 5.359066 0.828615 0.796355
C -6.279370 0.805941 0.463573
C 5.919829 -0.636217 -1.095613
C -5.279162 -1.428315 0.722139
C 2.147585 -0.780092 -0.325784
C -2.586425 1.287742 1.036935
C 1.280040 -1.522924 -1.101412
C -1.275392 0.894698 1.253086
C 1.567134 -2.290537 -2.325265
C -0.213444 1.925865 1.374055
C 8.163531 1.520684 0.957255
C -8.836728 -0.501280 0.086379
H 3.264476 0.875928 1.340868
H -4.898518 2.460044 0.617846
H 4.279418 -1.718358 -1.998679
H -3.152351 -1.500654 1.070855
H 5.642997 1.540896 1.576796
H -7.141080 1.457919 0.295194
H 6.683888 -1.042355 -1.765676
H -5.416889 -2.513317 0.744607
H 1.644486 -0.283368 0.519196
H -2.698242 2.380798 0.975363
H 7.968382 1.137416 1.977287
H 9.247606 1.600332 0.790776
H 7.692068 2.514998 0.836443
H -9.639541 -1.244476 -0.019476
H -9.055422 0.168635 0.939354
H -8.746956 0.090034 -0.844446
H 0.592956 -3.287129 -3.726600
H 0.064760 3.866712 1.363896


