%chk=000214842.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214842

0 1
S -3.378954 1.560153 -0.045948
S -2.934655 -1.908054 0.054322
O -0.307842 2.517394 -0.119841
O 0.264523 -2.074768 0.096681
N 0.373652 0.274305 -0.013910
C 1.854097 0.488689 -0.023527
C 2.470839 -0.063819 1.275868
C 2.472365 -0.185366 -1.263455
C 3.989826 0.149345 1.263597
C 3.991339 0.028180 -1.269797
C 4.632858 -0.490477 0.024986
C -0.583825 1.351457 -0.063826
C -0.279857 -1.006888 0.044229
C -1.926445 0.662276 -0.026740
C -1.755381 -0.674322 0.021044
C -4.598652 0.284082 0.419816
C -4.443250 -0.980566 -0.389452
H 2.014628 1.600719 -0.076671
H 2.240938 -1.145299 1.374067
H 2.020399 0.427948 2.156996
H 2.022972 0.219807 -2.188106
H 2.242651 -1.271354 -1.258219
H 4.432241 -0.280483 2.182227
H 4.220357 1.231915 1.291744
H 4.221917 1.103144 -1.400833
H 4.434844 -0.487310 -2.142689
H 5.719537 -0.286854 0.015894
H 4.526566 -1.591869 0.077594
H -5.594739 0.747906 0.249171
H -4.530233 0.087366 1.510178
H -5.287860 -1.679738 -0.204463
H -4.443356 -0.774919 -1.480338


%chk=000214842-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214842

0 1
S -3.407974 1.674738 -0.030286
S -2.994281 -2.014201 0.027559
O -0.277254 2.514634 -0.116820
O 0.227431 -2.160815 0.069816
N 0.374600 0.223441 -0.027458
C 1.844693 0.424067 -0.030016
C 2.487860 -0.088372 1.283130
C 2.505235 -0.216228 -1.276874
C 4.013002 0.175579 1.275112
C 4.030515 0.047981 -1.273299
C 4.688267 -0.455598 0.033813
C -0.564246 1.292833 -0.069831
C -0.302937 -1.021763 0.025878
C -1.927378 0.661427 -0.039800
C -1.774848 -0.699632 0.012668
C -4.652210 0.317791 0.440170
C -4.524149 -0.966791 -0.391358
H 1.975937 1.524057 -0.083927
H 2.296927 -1.173910 1.379765
H 2.013255 0.413099 2.148063
H 2.043575 0.196953 -2.193934
H 2.313639 -1.305717 -1.268127
H 4.463544 -0.224546 2.203459
H 4.198760 1.269764 1.275162
H 4.216883 1.136958 -1.379797
H 4.493783 -0.442255 -2.150773
H 5.770669 -0.223583 0.029551
H 4.594004 -1.559479 0.088601
H -5.632055 0.791140 0.256958
H -4.543225 0.113893 1.516627
H -5.367334 -1.644379 -0.173191
H -4.503186 -0.748486 -1.470240


