%chk=000259077.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259077

0 1
S -2.438835 0.846443 0.677441
N 0.137861 0.158171 0.402591
C 1.130906 -0.981333 0.407954
C 2.219065 -0.707656 -0.656235
C 2.922437 0.631083 -0.414815
C 0.805128 1.478388 0.667087
C 1.884637 1.757653 -0.388350
C 0.421819 -2.302007 0.071871
C -0.982995 -0.046875 1.345077
C -2.591753 0.247723 -1.036040
C -3.351424 -1.059706 -1.077037
H 1.622299 -1.075975 1.411287
H 1.755111 -0.705849 -1.662845
H 2.952467 -1.533810 -0.653248
H 3.670096 0.816803 -1.208078
H 3.486066 0.605040 0.536719
H 1.248765 1.530680 1.684772
H 0.022840 2.270000 0.610558
H 2.367049 2.729423 -0.178666
H 1.409415 1.853424 -1.385363
H 1.140951 -3.119096 -0.042186
H -0.290687 -2.595201 0.852141
H -0.143030 -2.219002 -0.866258
H -0.829189 0.359628 2.366958
H -1.240851 -1.122488 1.447073
H -3.116318 1.045680 -1.595775
H -1.578167 0.147877 -1.478863
H -2.810941 -1.864103 -0.561867
H -4.338381 -0.978328 -0.601324
H -3.516042 -1.389988 -2.111177


%chk=000259077-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259077

0 1
S -2.500972 1.005744 0.663401
N 0.189573 0.149576 0.506773
C 1.148874 -0.998593 0.427096
C 2.191001 -0.707668 -0.684585
C 2.908155 0.644339 -0.486349
C 0.849477 1.460875 0.731357
C 1.870656 1.781169 -0.374088
C 0.447197 -2.343268 0.142529
C -1.004752 -0.015949 1.319613
C -2.601761 0.260810 -1.074144
C -3.366378 -1.070637 -1.126039
H 1.709195 -1.089927 1.395381
H 1.663813 -0.710352 -1.659930
H 2.927153 -1.535034 -0.699903
H 3.609837 0.833108 -1.321086
H 3.514892 0.607785 0.442634
H 1.365090 1.476832 1.726600
H 0.053783 2.227817 0.754262
H 2.365289 2.745964 -0.150281
H 1.333729 1.894162 -1.335803
H 1.207900 -3.102761 -0.113311
H -0.121530 -2.730978 1.006018
H -0.240840 -2.243216 -0.717503
H -0.909325 0.358975 2.362836
H -1.319384 -1.067448 1.347135
H -3.087877 1.035594 -1.691262
H -1.551173 0.154032 -1.402181
H -2.880946 -1.835200 -0.492358
H -4.404507 -0.947850 -0.770966
H -3.397871 -1.461302 -2.162447


