%chk=000281313.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281313

0 1
S 0.451262 -1.626441 0.000684
O -4.079831 1.891525 0.001270
N -0.737462 0.763716 0.002153
N -1.816655 1.551187 0.002260
N -3.358101 -0.334315 -0.000354
N -2.472433 -2.488397 -0.002094
C 1.881342 -0.595590 0.000226
C -0.922764 -0.544337 0.000811
C 2.452102 -0.227803 1.220218
C 2.452306 -0.229280 -1.220116
C -2.268260 -1.135482 -0.000497
C 3.637446 0.515539 1.213873
C 3.637655 0.514057 -1.214473
C 4.227751 0.883695 -0.000474
C -3.213716 1.053649 0.001014
H 1.985447 -0.509504 2.165116
H 1.985819 -0.512129 -2.164752
H 4.098083 0.810361 2.155710
H 4.098459 0.807725 -2.156590
H 5.150547 1.463852 -0.000748
H -1.628116 2.563939 0.003238
H -3.417604 -2.852935 -0.002986
H -1.714377 -3.150633 -0.002288


%chk=000281313-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281313

0 1
S 0.466762 -1.791781 0.001301
O -4.103485 1.957599 0.001774
N -0.711101 0.707339 0.003308
N -1.816164 1.515664 0.003266
N -3.376508 -0.299340 -0.000693
N -2.539273 -2.472408 -0.003021
C 1.933589 -0.663844 0.000432
C -0.937707 -0.599215 0.001303
C 2.499122 -0.262238 1.230124
C 2.499884 -0.265245 -1.229890
C -2.313931 -1.119478 -0.000788
C 3.652831 0.555212 1.224836
C 3.653615 0.552193 -1.225887
C 4.229908 0.962523 -0.000847
C -3.193861 1.088695 0.001387
H 2.043775 -0.581508 2.172841
H 2.045124 -0.586814 -2.172112
H 4.096089 0.871036 2.175357
H 4.097483 0.865660 -2.176904
H 5.124650 1.594864 -0.001342
H -1.628302 2.520905 0.004753
H -3.510622 -2.783390 -0.004414
H -1.782977 -3.154030 -0.003580


