%chk=000298392.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298392

0 1
S 1.368392 -0.474997 -2.618511
S -1.487987 0.472561 -2.482079
P -1.854705 -0.421448 -0.613303
O -3.285705 0.254623 -0.153082
O -0.724354 -0.214983 0.341294
C 3.931786 -0.208545 0.619927
C 3.314848 0.058011 -0.762334
C 5.199555 0.628463 0.838622
C 2.061041 -0.779264 -0.965874
C -3.212183 1.402803 0.765877
C 5.816875 0.368170 2.210958
C 0.278548 0.944602 -2.372024
C -3.378191 2.657307 -0.079719
C -4.381051 1.150115 1.709203
C -2.388189 -2.145057 -1.018465
H 4.168552 -1.284108 0.728598
H 3.190728 0.016363 1.412306
H 4.060400 -0.159865 -1.553821
H 3.080498 1.136768 -0.860887
H 4.962180 1.705366 0.734424
H 5.940784 0.403965 0.046737
H 2.278498 -1.863524 -0.912067
H 1.301590 -0.578576 -0.171804
H -2.240869 1.398945 1.317673
H 5.119245 0.613964 3.019919
H 6.100969 -0.683211 2.333037
H 6.718916 0.971687 2.360551
H 0.499828 1.473761 -1.424148
H 0.440882 1.661512 -3.203257
H -3.668770 3.520015 0.529163
H -2.458924 2.924247 -0.614347
H -4.156494 2.513222 -0.843446
H -4.520898 1.978915 2.410506
H -4.228463 0.232596 2.291128
H -5.316818 1.016527 1.149152
H -2.490595 -2.748170 -0.104777
H -1.658898 -2.649744 -1.670100
H -3.360223 -2.156015 -1.532928


%chk=000298392-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298392

0 1
S 1.300000 -0.650987 -2.598179
S -1.431198 0.985978 -2.490245
P -1.837340 -0.226455 -0.545553
O -3.423640 0.257578 -0.044659
O -0.660261 -0.008461 0.523358
C 4.132177 -0.330983 0.610276
C 3.452029 -0.067955 -0.755466
C 5.423094 0.497013 0.810483
C 2.169257 -0.898606 -0.918746
C -3.612764 1.551144 0.707754
C 6.098425 0.231830 2.173366
C 0.455777 1.003350 -2.285598
C -4.160131 2.602053 -0.266572
C -4.565598 1.217108 1.860302
C -2.192217 -1.964955 -1.077740
H 4.373987 -1.410794 0.700222
H 3.418646 -0.101157 1.428238
H 4.156220 -0.302054 -1.578002
H 3.212359 1.011383 -0.841914
H 5.181474 1.575676 0.719670
H 6.135086 0.267137 -0.008276
H 2.389463 -1.981463 -0.895874
H 1.417020 -0.671822 -0.142259
H -2.626259 1.861651 1.107021
H 5.417208 0.482141 3.008412
H 6.377083 -0.833929 2.276723
H 7.017221 0.834802 2.293863
H 0.688557 1.324464 -1.258525
H 0.804519 1.743937 -3.020016
H -4.333099 3.556515 0.264652
H -3.449283 2.783443 -1.091058
H -5.119247 2.262624 -0.695723
H -4.779292 2.126973 2.451002
H -4.122365 0.459589 2.528305
H -5.519269 0.824585 1.465789
H -2.415383 -2.576171 -0.189158
H -1.298802 -2.340470 -1.600767
H -3.052655 -1.957711 -1.763006


