%chk=000270927.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270927

0 1
S -0.380140 -3.233627 0.404085
O 0.376633 2.503141 1.283274
O 4.166416 -0.082803 -1.548567
N 0.097815 -0.536864 0.724692
N 1.720748 -1.655113 -0.446979
N 2.250926 2.469408 -0.002997
N 3.371299 1.732550 -0.463232
C 1.071267 0.392013 0.362272
C -1.153239 -0.227112 1.447696
C 2.067076 -0.322989 -0.349159
C 0.525442 -1.764731 0.203285
C -2.255845 0.150460 0.487412
C 1.160198 1.821723 0.644205
C 3.254909 0.355989 -0.886740
C -3.132081 -0.825257 -0.006644
C -2.404718 1.490298 0.100485
C -4.155201 -0.458273 -0.885862
C -3.429339 1.850283 -0.778008
C -4.305064 0.877507 -1.272008
C 0.855449 -4.506246 0.094240
H -0.950106 0.621764 2.156076
H -1.441459 -1.103764 2.076857
H 2.527054 3.384887 0.392255
H 3.987665 2.317135 -1.055992
H -3.020629 -1.868476 0.286273
H -1.718014 2.251476 0.485937
H -4.835036 -1.216408 -1.271955
H -3.544330 2.891004 -1.078485
H -5.102470 1.160174 -1.957591
H 0.340774 -5.474083 0.033230
H 1.609726 -4.550872 0.890680
H 1.390475 -4.334794 -0.854933


%chk=000270927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270927

0 1
S -0.411888 -3.203286 0.512807
O 0.386811 2.608229 1.277120
O 4.338112 -0.271019 -1.379736
N 0.133323 -0.457200 0.735455
N 1.766921 -1.659450 -0.333200
N 2.422863 2.411310 0.168323
N 3.426417 1.669996 -0.497779
C 1.145638 0.443094 0.388270
C -1.149457 -0.142939 1.432664
C 2.139056 -0.319673 -0.263315
C 0.558838 -1.707565 0.273270
C -2.301803 0.171876 0.482458
C 1.232152 1.871187 0.665178
C 3.379987 0.282463 -0.770328
C -3.215025 -0.838971 0.091040
C -2.474998 1.492713 -0.005792
C -4.281210 -0.538875 -0.786623
C -3.540842 1.791084 -0.883261
C -4.444827 0.776800 -1.277645
C 0.862546 -4.448727 -0.105603
H -0.940642 0.722916 2.081344
H -1.385889 -1.018378 2.064225
H 2.604876 3.404641 0.329069
H 4.241630 2.192305 -0.826832
H -3.093130 -1.860550 0.470259
H -1.776522 2.275152 0.313516
H -4.982298 -1.326772 -1.083530
H -3.670442 2.814164 -1.253735
H -5.272575 1.010731 -1.956652
H 0.361321 -5.426828 -0.048543
H 1.750655 -4.414092 0.539534
H 1.136605 -4.195937 -1.138155


