%chk=000266853.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266853

0 1
S 0.269596 1.068339 -0.895573
O -3.353713 2.837705 1.336851
O 0.057505 2.501051 -0.811648
O -0.037772 0.362428 -2.118688
N -0.686550 0.383431 0.386389
C -1.517088 1.291340 1.207609
C -2.627273 2.010277 0.411163
C -1.223311 -0.940018 0.205408
C -2.554264 -1.198790 -0.188375
C 1.876311 0.683344 -0.407842
C -3.586979 1.129825 -0.327183
C -3.540299 -0.183481 -0.574109
C -0.336754 -2.001990 0.484781
C -2.966768 -2.547850 -0.266712
C 2.517501 -0.440246 -0.943029
C 2.548383 1.499357 0.508739
C -0.770814 -3.320017 0.386248
C -2.094305 -3.594308 0.017351
C 4.494389 0.055890 0.373527
C 3.818521 -0.756644 -0.554651
C 3.850330 1.188858 0.901296
C 5.891838 -0.270499 0.779813
H -0.850651 2.062545 1.663013
H -1.958461 0.721377 2.055342
H -2.176681 2.775793 -0.282955
H -4.439241 1.709519 -0.709354
H -4.366028 -0.608107 -1.169131
H 0.684821 -1.782843 0.795776
H -3.992302 -2.774341 -0.562194
H 1.998606 -1.069363 -1.677202
H 2.057381 2.391154 0.913877
H -0.084962 -4.137978 0.601913
H -2.436991 -4.625013 -0.051964
H -3.926868 2.295890 1.914823
H 4.313008 -1.629733 -0.976405
H 4.368780 1.828638 1.613109
H 6.106107 -1.347258 0.730890
H 6.615303 0.230231 0.116114
H 6.120496 0.055086 1.804381


%chk=000266853-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266853

0 1
S 0.298115 1.201521 -0.782122
O -3.565719 3.131117 0.931330
O 0.197448 2.820515 -0.565708
O -0.025621 0.507754 -2.223377
N -0.860345 0.409520 0.685684
C -1.770890 1.466760 1.174043
C -2.852768 2.037991 0.220135
C -1.312336 -0.896891 0.366508
C -2.647022 -1.250933 -0.051577
C 2.038365 0.675138 -0.294238
C -3.848743 1.034538 -0.292647
C -3.748868 -0.327445 -0.362222
C -0.336171 -1.924571 0.531575
C -2.930056 -2.639661 -0.230869
C 2.619920 -0.400659 -0.983276
C 2.704342 1.408290 0.700677
C -0.639862 -3.277557 0.312109
C -1.957482 -3.640212 -0.063423
C 4.659650 -0.060573 0.364781
C 3.941647 -0.761883 -0.639953
C 4.023496 1.024726 1.025959
C 6.091157 -0.436755 0.699829
H -1.152951 2.320600 1.499385
H -2.257626 1.038629 2.074767
H -2.351999 2.572925 -0.607494
H -4.780087 1.496044 -0.650904
H -4.637097 -0.842448 -0.755894
H 0.658165 -1.627867 0.880407
H -3.945783 -2.924516 -0.531664
H 2.060781 -0.919855 -1.768487
H 2.217474 2.258974 1.187512
H 0.129067 -4.043813 0.456513
H -2.219304 -4.691549 -0.222968
H -4.145821 2.721482 1.625373
H 4.421031 -1.596468 -1.164245
H 4.567078 1.580089 1.798863
H 6.288574 -1.504270 0.501517
H 6.803297 0.148860 0.086752
H 6.327742 -0.233950 1.758748


