%chk=000278784.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278784

0 1
S -0.886595 1.839451 -0.420637
S 2.079247 1.228083 0.654174
O 0.236864 -2.144141 -1.719441
O -1.471752 2.273773 -1.663257
O 0.131467 2.609173 0.267004
O 2.213868 -3.218190 -1.652252
N -0.070755 0.337600 -0.778289
C 1.955133 -1.092635 -0.521726
C 1.198544 0.051696 -0.327845
C 3.249412 -1.031951 0.161934
C 3.448183 0.133431 0.835533
C -2.124032 1.360618 0.661282
C 4.205497 -2.165402 0.110190
C 1.576235 -2.244335 -1.316170
C 4.586976 0.597245 1.644425
C -1.829537 1.139439 2.014116
C -3.437899 1.200387 0.201439
C -4.154355 0.583183 2.435416
C -2.835353 0.751970 2.896462
C -4.448364 0.813065 1.079371
C -5.223847 0.166563 3.385989
C -0.277849 -3.162319 -2.627094
C 0.079648 -2.790877 -4.052151
H -0.476999 -0.365626 -1.437166
H 4.281368 -2.582398 -0.910860
H 5.214939 -1.883923 0.432189
H 3.864752 -2.996133 0.747230
H 5.409981 -0.135056 1.647014
H 5.003845 1.542286 1.261982
H 4.302475 0.761914 2.695091
H -0.806472 1.277101 2.385031
H -3.675881 1.387354 -0.853192
H -2.600118 0.579794 3.946030
H -5.466776 0.691108 0.713565
H -6.208180 0.058009 2.910116
H -4.988279 -0.800608 3.857236
H -5.342315 0.896953 4.201819
H 0.134285 -4.144750 -2.329766
H -1.361184 -3.113422 -2.420856
H -0.408132 -3.453475 -4.775730
H -0.210998 -1.759633 -4.288229
H 1.165251 -2.863519 -4.217676


%chk=000278784-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278784

0 1
S -1.364879 0.131038 -0.715800
S 1.329913 -0.944545 1.986214
O 0.741949 -2.551480 -2.284069
O -2.315063 -0.318492 -1.979165
O -0.191866 1.263753 -0.889024
O 3.006435 -2.135708 -2.667564
N -0.444123 -1.721000 0.058321
C 2.059402 -1.757341 -0.450026
C 0.880834 -1.544560 0.327327
C 3.292640 -1.488020 0.257519
C 3.079882 -1.025579 1.565088
C -2.494738 0.712202 0.668511
C 4.665827 -1.671954 -0.348282
C 2.027920 -2.150647 -1.879067
C 4.075357 -0.604803 2.609306
C -1.994891 1.659848 1.578351
C -3.793450 0.185224 0.738052
C -4.178113 1.594416 2.727395
C -2.853851 2.097056 2.608405
C -4.633172 0.641095 1.779562
C -5.085391 2.080700 3.842889
C 0.527697 -2.788068 -3.749653
C 0.129160 -1.482862 -4.442686
H -0.546645 -2.223691 -0.853237
H 4.805355 -0.997955 -1.210656
H 5.464478 -1.481661 0.386385
H 4.789974 -2.695920 -0.741549
H 5.106625 -0.684717 2.230763
H 3.912393 0.444898 2.918241
H 4.000029 -1.229934 3.519036
H -0.979675 2.052974 1.464474
H -4.142336 -0.536287 -0.007302
H -2.491982 2.840564 3.328387
H -5.654405 0.250698 1.853375
H -6.071615 1.588093 3.809651
H -4.640587 1.881252 4.835524
H -5.250522 3.172235 3.774872
H 1.456761 -3.214432 -4.165517
H -0.280901 -3.536063 -3.773298
H -0.114910 -1.690116 -5.501517
H -0.755134 -1.033378 -3.958538
H 0.957915 -0.755030 -4.418396


