%chk=000260051.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260051

0 1
S -1.352095 -3.158837 0.707497
O 5.051298 1.734951 -0.495784
O -5.105707 0.004600 0.476056
O -3.168253 1.229142 0.623884
N -0.823886 -0.640611 0.252203
N -3.203510 -1.146128 0.525433
C 1.642794 -0.575890 0.062382
C 0.414881 -1.344145 0.277372
C 2.841669 -1.228424 -0.265533
C 1.629643 0.834183 0.180787
C 3.982493 0.886341 -0.334272
C 4.021554 -0.507762 -0.465599
C 2.789321 1.569293 -0.011785
C 0.307361 -2.692478 0.503632
C -1.844819 -1.447034 0.464691
C -5.912604 1.230336 0.451530
C -3.731243 0.171745 0.539044
C -5.808274 1.895751 -0.902108
C 6.335816 1.156071 -0.831953
H 2.861300 -2.313772 -0.373369
H 0.690700 1.345621 0.424909
H 4.937304 -1.029669 -0.718512
H 2.799641 2.653753 0.077032
H 1.096880 -3.418778 0.568907
H -3.873917 -1.925111 0.505422
H -6.912750 0.805251 0.659034
H -5.578936 1.882550 1.278283
H -6.515267 2.728990 -0.996251
H -4.798416 2.303505 -1.071352
H -6.011302 1.191347 -1.719372
H 6.281361 0.645523 -1.797595
H 6.672531 0.488884 -0.033531
H 6.973231 2.048104 -0.894185


%chk=000260051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260051

0 1
S -1.423823 -3.274954 0.418677
O 5.143389 1.782853 -0.513136
O -5.084338 0.079908 0.621197
O -3.071396 1.292921 0.375440
N -0.797678 -0.673100 0.203326
N -3.173627 -1.089939 0.463207
C 1.672718 -0.617115 -0.038919
C 0.422735 -1.385367 0.126823
C 2.943257 -1.241147 -0.121644
C 1.612587 0.804583 -0.118969
C 4.041575 0.928532 -0.357498
C 4.123225 -0.485503 -0.279407
C 2.778997 1.568738 -0.276300
C 0.290346 -2.766823 0.220034
C -1.833969 -1.457566 0.351559
C -5.855260 1.357697 0.617426
C -3.689177 0.215961 0.470435
C -6.174919 1.801184 -0.812508
C 6.470504 1.169701 -0.599887
H 3.027162 -2.332443 -0.063056
H 0.632800 1.287154 -0.053600
H 5.086336 -1.001061 -0.339295
H 2.738866 2.660355 -0.337900
H 1.060380 -3.533317 0.187657
H -3.873861 -1.827748 0.560576
H -6.763735 1.111023 1.189744
H -5.265416 2.122721 1.152561
H -6.813648 2.703699 -0.787801
H -5.250884 2.050206 -1.360795
H -6.716324 1.010423 -1.360002
H 6.547580 0.497124 -1.476514
H 6.715778 0.607077 0.322134
H 7.168617 2.011524 -0.716667


