%chk=000225590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225590

0 1
S 1.108854 0.180388 -0.579006
O 0.850206 0.632001 -1.932738
O 0.576027 -1.099419 -0.137457
N 0.469541 1.384097 0.480369
C -2.064136 1.553528 0.374796
C -0.702903 2.153721 -0.011158
C -2.408864 0.278112 -0.406121
C -3.816342 -0.161327 -0.107683
C 2.795191 0.228938 -0.233392
C 3.397323 -0.833997 0.450790
C 3.569751 1.317613 -0.648676
C -4.058833 -1.151765 0.856648
C -4.898459 0.420602 -0.787259
C 5.544716 0.286567 0.313377
C 4.763488 -0.807875 0.726393
C 4.937559 1.350828 -0.375852
C -5.367635 -1.553253 1.136557
C -6.205018 0.015668 -0.503440
C -6.443421 -0.970714 0.459109
C 7.004496 0.324248 0.617695
H -2.851015 2.315965 0.198529
H -2.101835 1.343227 1.461678
H -0.619960 3.180759 0.417573
H -0.630814 2.276674 -1.119666
H -2.279388 0.445246 -1.496268
H -1.688618 -0.536444 -0.159163
H 0.341332 1.105026 1.461919
H 2.792492 -1.693813 0.766178
H 3.106617 2.146508 -1.193973
H -3.224643 -1.613125 1.382423
H -4.718689 1.185393 -1.539563
H 5.225287 -1.637408 1.258476
H 5.534194 2.201068 -0.700672
H -5.549068 -2.324108 1.883353
H -7.039862 0.468436 -1.035141
H -7.460799 -1.285322 0.677526
H 7.577319 0.885975 -0.133695
H 7.186785 0.810156 1.589366
H 7.449825 -0.679174 0.672868


%chk=000225590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225590

0 1
S 1.069355 0.086898 -0.439853
O 0.752521 0.649294 -1.937503
O 0.587945 -1.399291 0.048721
N 0.406617 1.398535 0.751175
C -2.143622 1.615395 0.417567
C -0.727410 2.193305 0.194955
C -2.468958 0.350288 -0.425869
C -3.888201 -0.139525 -0.173424
C 2.923899 0.192136 -0.145811
C 3.512943 -0.774772 0.682435
C 3.648614 1.205397 -0.792446
C -4.139660 -1.215402 0.716523
C -4.996768 0.494661 -0.793868
C 5.691229 0.305516 0.261554
C 4.910448 -0.706678 0.878781
C 5.043280 1.250088 -0.579905
C -5.460388 -1.643150 0.985046
C -6.318390 0.070651 -0.530512
C -6.555492 -1.000032 0.363476
C 7.187261 0.386084 0.503226
H -2.877210 2.408387 0.168581
H -2.289579 1.390530 1.494699
H -0.643017 3.189458 0.672426
H -0.525602 2.330746 -0.885690
H -2.328047 0.596516 -1.495882
H -1.748992 -0.456341 -0.189603
H 0.136969 0.851269 1.593567
H 2.902709 -1.566153 1.129477
H 3.145163 1.916358 -1.454772
H -3.292676 -1.726402 1.191118
H -4.820095 1.319349 -1.496636
H 5.399023 -1.453098 1.515306
H 5.636383 2.026502 -1.076513
H -5.634324 -2.479911 1.671519
H -7.161081 0.568566 -1.024208
H -7.579715 -1.332702 0.566961
H 7.721581 0.769356 -0.383440
H 7.412775 1.071027 1.343486
H 7.611215 -0.599856 0.760035


