%chk=000145281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000145281

0 1
S -2.454695 -0.006709 -0.031815
O -2.642053 -1.436251 0.031337
O -3.623610 0.837832 -0.163449
N -1.386167 0.402992 -1.307200
C 1.095458 -0.047940 1.142605
C 1.109312 -0.118764 -1.135744
C 2.136700 0.265244 -0.002917
C -0.084059 0.903010 0.766812
C -0.073923 0.858323 -0.819581
C 0.698145 -1.513162 0.820511
C 0.699508 -1.557950 -0.731479
C -1.453499 0.526224 1.321760
C 2.618570 1.719453 -0.044284
C 3.385998 -0.618071 0.031405
H 1.463130 0.098958 2.162807
H 1.477368 -0.034062 -2.162219
H 0.166888 1.933059 1.105962
H 0.163033 1.866153 -1.236216
H -0.283716 -1.794172 1.232656
H 1.421132 -2.223061 1.250470
H 1.411172 -2.300341 -1.121501
H -0.288783 -1.840865 -1.134994
H -1.362850 -0.258567 2.101109
H -1.912802 1.380231 1.856534
H -1.713147 0.839748 -2.168219
H 3.263112 1.940967 0.814816
H 3.208037 1.907161 -0.949726
H 1.813915 2.459159 -0.031295
H 3.986885 -0.416643 0.925049
H 3.158246 -1.689460 0.036904
H 4.019792 -0.436296 -0.843997


%chk=000145281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145281

0 1
S -2.561041 -0.090056 -0.044793
O -2.679836 -1.701192 0.078558
O -3.914919 0.793594 -0.245049
N -1.348567 0.389369 -1.401474
C 1.122646 -0.057902 1.142639
C 1.139751 -0.122315 -1.134122
C 2.162426 0.259918 -0.000745
C -0.054362 0.903406 0.783996
C -0.059852 0.837601 -0.841884
C 0.700860 -1.524052 0.820917
C 0.709301 -1.564251 -0.751623
C -1.408015 0.598024 1.404851
C 2.666760 1.727174 -0.041322
C 3.421755 -0.639397 0.034898
H 1.497940 0.092479 2.170120
H 1.511667 -0.016950 -2.167037
H 0.207124 1.938499 1.062787
H 0.152737 1.847769 -1.237809
H -0.292072 -1.790967 1.222368
H 1.418506 -2.239484 1.257894
H 1.424854 -2.308083 -1.140682
H -0.281441 -1.809061 -1.167229
H -1.425180 -0.207678 2.152126
H -1.969454 1.484168 1.735733
H -1.857628 1.106163 -1.946655
H 3.278738 1.945804 0.854181
H 3.312241 1.879711 -0.926537
H 1.868002 2.486909 -0.086945
H 4.038768 -0.398689 0.921464
H 3.191209 -1.715395 0.069045
H 4.044179 -0.458915 -0.861569


