%chk=000110491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000110491

0 1
S 1.751871 0.943030 0.218248
O 2.149888 0.297224 -1.016228
O 2.240848 2.278583 0.526039
O -4.116608 0.894417 0.576960
O -1.228217 -2.964732 0.009509
N 2.239119 -0.045903 1.537749
N -2.897791 -1.381620 -0.000468
C 2.859701 -1.361652 1.236037
C 4.396814 -1.356486 1.254887
C 0.024777 0.956359 0.339236
C 5.007068 -0.532564 0.113672
C -0.694473 -0.226382 0.118687
C -2.089496 -0.222519 0.210757
C -0.627741 2.147244 0.647131
C 6.496373 -0.819501 -0.059073
C -2.746141 1.011589 0.522446
C -2.024919 2.185194 0.737057
C -2.412710 -2.702862 -0.073877
C -4.890870 2.090180 0.848132
C -3.489825 -3.732203 -0.271462
H 2.482050 -2.080088 2.002475
H 2.493777 -1.737227 0.250317
H 4.770962 -0.985983 2.227797
H 4.749658 -2.405517 1.184901
H 2.721246 0.433024 2.310268
H 4.856608 0.548931 0.301736
H 4.466507 -0.738726 -0.836218
H -0.169709 -1.164167 -0.127135
H -0.051442 3.066005 0.818940
H 6.922095 -0.201897 -0.858970
H 6.678832 -1.866694 -0.324508
H 7.059807 -0.605603 0.855493
H -2.522636 3.120955 0.973666
H -3.905371 -1.205690 -0.045452
H -5.917344 1.701297 0.819308
H -4.728369 2.833179 0.061469
H -4.645940 2.481355 1.840256
H -4.209434 -3.755446 0.557384
H -3.035674 -4.736773 -0.329193
H -4.048792 -3.583129 -1.205075


%chk=000110491-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000110491

0 1
S 1.789601 0.429583 -0.058604
O 2.039997 -0.544742 -1.340489
O 2.420095 1.939407 0.014039
O -4.177549 0.968178 0.705432
O -1.837494 -3.210231 -0.447066
N 2.319683 -0.548840 1.472062
N -3.224412 -1.386196 0.047379
C 3.268062 -1.660806 1.171030
C 4.770642 -1.310914 1.261203
C -0.060936 0.609681 0.211226
C 5.271866 -0.323226 0.181552
C -0.876063 -0.517658 0.017034
C -2.268373 -0.355679 0.199152
C -0.531254 1.879360 0.565509
C 6.788909 -0.059551 0.293831
C -2.780814 0.934638 0.561506
C -1.925592 2.038907 0.739746
C -2.993138 -2.730419 -0.256868
C -4.804974 2.247182 1.053659
C -4.251146 -3.589412 -0.343275
H 3.012860 -2.466636 1.886858
H 3.017968 -2.033625 0.157812
H 4.996157 -0.906553 2.271684
H 5.341376 -2.258806 1.175781
H 2.731940 0.179042 2.090153
H 4.726170 0.638512 0.258390
H 5.031877 -0.729315 -0.820254
H -0.477343 -1.492461 -0.272594
H 0.165913 2.714871 0.678274
H 7.128439 0.648646 -0.483527
H 7.367251 -0.995855 0.175308
H 7.047761 0.372297 1.279713
H -2.324982 3.019901 1.009895
H -4.190806 -1.081701 0.196843
H -5.882831 2.036576 1.104197
H -4.606482 3.007962 0.275683
H -4.446435 2.608013 2.035894
H -5.186147 -3.033630 -0.157460
H -4.173184 -4.412586 0.387716
H -4.302111 -4.048711 -1.345526


