%chk=000215657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215657

0 1
S 4.916006 -1.603947 -0.063248
O 1.659886 0.623134 0.007553
O 1.815053 -1.648639 -0.055473
C -4.745992 -0.522959 -0.007018
C -4.012269 0.851903 0.029797
C -4.379944 -1.292105 -1.287435
C -4.373075 -1.363070 1.225917
C -6.264494 -0.248595 0.004905
C -2.514365 0.748563 0.022724
C -1.804793 0.673616 1.234611
C -1.811495 0.742851 -1.195341
C -0.411815 0.583749 1.240872
C -0.418572 0.653698 -1.214381
C 0.250344 0.582445 0.010372
C 2.367647 -0.578264 -0.027519
C 3.791884 -0.286643 -0.023491
C 4.452463 0.915537 0.007992
C 5.881111 0.761448 -0.000348
C 6.281494 -0.546020 -0.037775
H -4.353020 1.461362 -0.831627
H -4.348094 1.411691 0.926164
H -3.311079 -1.536007 -1.315078
H -4.926610 -2.238371 -1.353739
H -4.610940 -0.716016 -2.187742
H -3.304061 -1.607737 1.233993
H -4.599380 -0.838862 2.158525
H -4.919340 -2.311758 1.241499
H -6.833794 -1.183862 -0.019821
H -6.571625 0.292566 0.904774
H -6.576527 0.342239 -0.861407
H -2.345606 0.679842 2.180367
H -2.357489 0.802803 -2.136225
H 0.149662 0.519151 2.169767
H 0.137765 0.642195 -2.148529
H 3.959290 1.881987 0.036214
H 6.549457 1.612414 0.021369
H 7.290620 -0.926740 -0.051216


%chk=000215657-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215657

0 1
S 5.388806 -0.433920 1.519364
O 1.723973 0.350862 0.002961
O 2.351547 -0.384493 2.166115
C -4.857667 -0.511760 -0.141990
C -4.042377 0.776127 0.253813
C -4.525770 -0.947239 -1.592538
C -4.547381 -1.677795 0.831355
C -6.365404 -0.153112 -0.048170
C -2.526902 0.651254 0.227682
C -1.799902 0.246618 1.376362
C -1.785320 0.947369 -0.947882
C -0.392521 0.119742 1.376536
C -0.382261 0.830894 -0.977653
C 0.307161 0.415220 0.183293
C 2.646935 -0.040140 0.995979
C 4.005652 0.018210 0.448005
C 4.444653 0.382943 -0.824195
C 5.870296 0.312749 -0.977126
C 6.521516 -0.105452 0.178536
H -4.355804 1.588466 -0.432396
H -4.368625 1.073590 1.270508
H -3.460961 -1.221973 -1.697788
H -5.133565 -1.826234 -1.878869
H -4.744726 -0.135525 -2.313054
H -3.482201 -1.967090 0.787172
H -4.784295 -1.400290 1.876611
H -5.152731 -2.566894 0.572456
H -6.993311 -1.024761 -0.311846
H -6.637529 0.162782 0.977052
H -6.623715 0.672212 -0.738937
H -2.343408 0.028041 2.303244
H -2.314339 1.280014 -1.848484
H 0.143847 -0.191970 2.272788
H 0.190065 1.062194 -1.881105
H 3.750693 0.688436 -1.609091
H 6.395235 0.560716 -1.902313
H 7.588638 -0.246189 0.343605


