%chk=000291815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291815

0 1
S 4.928043 0.097639 0.058119
O -1.174666 1.913909 -0.017730
O 0.390138 3.557408 -0.040094
N 0.116102 0.019359 0.028591
C -2.398989 -0.188539 0.016402
C -1.110573 0.494336 0.011083
C 1.016855 1.132856 0.012242
C 2.366998 1.109656 0.021390
C 3.182206 -0.069726 0.049974
C -2.444081 -1.593784 0.043443
C -3.590451 0.558652 -0.005454
C 0.186226 2.384331 -0.018112
C 2.848481 -1.400393 0.074075
C -3.680037 -2.243645 0.048477
C -4.819737 -0.101770 -0.000176
C -4.865271 -1.500496 0.026740
C 3.992182 -2.276317 0.098928
C 5.185435 -1.617261 0.093788
H 2.898441 2.076978 0.005625
H -1.514915 -2.168228 0.060342
H -3.543053 1.651220 -0.026413
H 1.827364 -1.775511 0.074670
H -3.719596 -3.332202 0.069407
H -5.744770 0.473854 -0.017063
H -5.827756 -2.012407 0.030776
H 3.880619 -3.353206 0.119600
H 6.178905 -2.034414 0.108572


%chk=000291815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291815

0 1
S 5.004822 0.103174 0.056245
O -1.184048 1.991119 -0.018349
O 0.543328 3.620930 -0.039286
N 0.092711 0.049658 0.028633
C -2.404065 -0.146592 0.015903
C -1.133018 0.566282 0.010358
C 0.985103 1.149568 0.012437
C 2.370278 1.112062 0.021495
C 3.185627 -0.063385 0.049648
C -2.409846 -1.569733 0.044296
C -3.634748 0.566651 -0.006808
C 0.222836 2.423870 -0.017337
C 2.824249 -1.422107 0.075302
C -3.632620 -2.266439 0.049773
C -4.854194 -0.139785 -0.001104
C -4.857938 -1.554743 0.027157
C 3.938498 -2.316602 0.099487
C 5.173988 -1.670826 0.093067
H 2.862834 2.093476 0.005023
H -1.453367 -2.101585 0.061525
H -3.618249 1.660415 -0.028533
H 1.773811 -1.719034 0.075677
H -3.636124 -3.361424 0.071537
H -5.801115 0.410043 -0.018639
H -5.808077 -2.100203 0.031502
H 3.842393 -3.404486 0.120955
H 6.171032 -2.108004 0.107237


