%chk=000257488.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257488

0 1
S -1.280116 -1.674139 -0.000835
S 1.817431 -2.026523 0.002021
O -1.417951 -2.387066 1.251171
O -1.415732 -2.387583 -1.252795
N 0.599619 0.264594 0.000460
C 0.371885 -1.019851 0.000508
C -2.328061 -0.304282 -0.002060
C 2.821215 -0.608944 0.002630
C 1.989130 0.544665 0.001651
C -2.756135 0.245218 -1.215150
C -2.758136 0.245871 1.210024
C 4.213021 -0.500410 0.003857
C 2.562581 1.831675 0.001906
C -3.611695 1.350779 -1.216886
C -3.613697 1.351432 1.209754
C 4.765080 0.776728 0.004101
C 3.947244 1.929788 0.003135
C -4.037460 1.903787 -0.004066
H -2.430275 -0.193989 -2.164618
H -2.433843 -0.192821 2.160265
H 4.845069 -1.387012 0.004609
H 1.920866 2.712195 0.001157
H -3.945505 1.779267 -2.160555
H -3.949065 1.780427 2.152639
H 5.848654 0.898422 0.005056
H 4.421232 2.911782 0.003369
H -4.703656 2.767488 -0.004848


%chk=000257488-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257488

0 1
S -1.312472 -1.756795 -0.000790
S 1.911626 -2.128515 0.001988
O -1.488734 -2.541170 1.414001
O -1.486216 -2.541848 -1.415519
N 0.691757 0.281330 0.000592
C 0.465000 -0.998598 0.000604
C -2.432607 -0.224398 -0.002157
C 2.919665 -0.609232 0.002652
C 2.079797 0.553850 0.001747
C -2.842604 0.279424 -1.244399
C -2.844685 0.280132 1.239109
C 4.322973 -0.502487 0.003870
C 2.658462 1.844455 0.002068
C -3.725080 1.384367 -1.233463
C -3.727142 1.385066 1.226063
C 4.883826 0.794015 0.004178
C 4.061137 1.953759 0.003288
C -4.158818 1.934692 -0.004219
H -2.505102 -0.185422 -2.176256
H -2.508744 -0.184177 2.171798
H 4.965606 -1.387285 0.004560
H 2.008585 2.724095 0.001374
H -4.073252 1.809044 -2.180456
H -4.076901 1.810282 2.172229
H 5.973204 0.903852 0.005118
H 4.526814 2.944289 0.003557
H -4.844392 2.788773 -0.005036


