%chk=000240526.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240526

0 1
S 2.396168 0.734901 -0.428348
O 3.159797 1.724789 0.690701
O 3.435284 0.066943 -1.165370
O 1.432924 1.580557 -1.073078
N 2.655684 -1.015104 1.430521
C -0.531186 -0.868785 -0.798455
C 0.765769 -1.456193 -0.226795
C -1.641550 -0.761320 0.254817
C 1.552563 -0.448002 0.619359
C -2.904878 -0.119642 -0.334592
C -4.026601 -0.023030 0.708906
C -5.284068 0.616995 0.125160
H -0.876054 -1.501926 -1.640358
H -0.342692 0.132587 -1.249585
H 1.393977 -1.849523 -1.054662
H 0.523570 -2.345385 0.392501
H -1.881432 -1.764378 0.656713
H -1.289213 -0.163391 1.117741
H 0.835053 0.089826 1.300303
H -3.254731 -0.701680 -1.208695
H -2.667653 0.890360 -0.724577
H -3.679974 0.565610 1.580925
H -4.267623 -1.031024 1.099126
H 2.299098 -1.411989 2.296767
H 3.127505 -1.771462 0.930658
H -5.678278 0.039055 -0.718427
H -5.088169 1.632627 -0.238538
H -6.079141 0.686078 0.875924
H 3.931352 1.327504 1.136059


%chk=000240526-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240526

0 1
S 2.255032 2.464760 1.926477
O 3.859830 1.039505 1.028782
O 0.970743 1.450504 1.883696
O 2.229064 3.540431 0.709261
N 2.746823 -1.076631 0.237753
C -0.725091 -1.796208 -0.609460
C 0.546230 -2.283975 0.151004
C -1.661345 -0.896045 0.231080
C 1.468911 -1.148591 0.505212
C -2.937605 -0.493833 -0.542955
C -3.889538 0.400591 0.283738
C -5.162385 0.799990 -0.493435
H -1.284036 -2.694530 -0.938961
H -0.420036 -1.260665 -1.530453
H 1.086353 -3.052343 -0.436964
H 0.217238 -2.760712 1.098595
H -1.950266 -1.434780 1.157952
H -1.131769 0.021222 0.555229
H 1.048396 -0.270577 1.034470
H -3.480606 -1.407593 -0.865376
H -2.650173 0.042743 -1.471344
H -3.345259 1.312208 0.601749
H -4.174063 -0.132192 1.214087
H 3.423116 0.070679 0.642947
H 3.173290 -1.882897 -0.251675
H -5.737130 -0.094223 -0.801453
H -4.906493 1.365791 -1.409201
H -5.827874 1.434986 0.119620
H 4.274143 1.597385 0.324325


