%chk=000277873.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277873

0 1
S 2.174816 -2.009012 -0.403093
O 2.189863 -2.404498 -1.792169
O 3.127099 -2.561505 0.534242
O -0.476626 -0.704014 1.931748
N 0.644654 -2.566165 0.281104
N -0.444341 -1.755416 -0.097288
C 2.168983 -0.290656 -0.315608
C 2.108410 0.366207 0.919939
C 2.257798 0.458821 -1.495095
C 2.230234 2.512922 -0.206510
C 2.138628 1.758873 0.976953
C 2.287314 1.851894 -1.446043
C 2.268788 4.002265 -0.135626
C -2.309821 -0.250009 0.432296
C -1.039005 -0.897633 0.867281
C -3.368895 -0.185639 1.349796
C -2.442221 0.312450 -0.844699
C -4.569464 0.424601 0.977953
C -3.644441 0.925514 -1.207530
C -4.707776 0.977880 -0.299573
H 2.022609 -0.206760 1.850823
H 2.306354 -0.052810 -2.464878
H 2.086584 2.261324 1.941719
H 2.359997 2.425130 -2.367929
H 0.655900 -2.779996 1.301828
H -1.035976 -2.230195 -0.795819
H 2.248791 4.481970 -1.123221
H 1.416125 4.401882 0.433992
H 3.182312 4.350440 0.371529
H -3.247527 -0.604490 2.351035
H -1.609561 0.283222 -1.549165
H -5.395976 0.472974 1.686363
H -3.752077 1.364549 -2.198810
H -5.645254 1.454281 -0.587148


%chk=000277873-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277873

0 1
S 1.373702 -1.152594 -0.456283
O 0.047784 -0.821628 -1.393510
O 2.517531 -2.184604 -1.006154
O -1.420735 0.315059 1.511935
N 0.163648 -1.973574 1.330481
N -1.088080 -1.865419 0.807423
C 2.250039 0.488035 -0.092994
C 3.647177 0.520647 -0.240725
C 1.486657 1.594774 0.308961
C 3.582874 2.896488 0.423587
C 4.305430 1.741258 0.019203
C 2.173165 2.804344 0.564132
C 4.310062 4.201230 0.693651
C -3.095037 -0.660286 0.008535
C -1.840262 -0.649195 0.803892
C -4.214989 0.066442 0.490661
C -3.169512 -1.340810 -1.237352
C -5.415888 0.076899 -0.247160
C -4.373320 -1.320118 -1.972734
C -5.499225 -0.622294 -1.475674
H 4.186935 -0.377302 -0.559210
H 0.398696 1.528566 0.424518
H 5.394681 1.796545 -0.093317
H 1.601258 3.684560 0.878533
H 0.285466 -1.119123 1.937331
H -1.401818 -2.663431 0.249636
H 3.624057 4.979242 1.068384
H 5.112474 4.066234 1.442227
H 4.787068 4.587496 -0.226744
H -4.128077 0.609627 1.437488
H -2.272195 -1.808338 -1.659386
H -6.283735 0.628487 0.129586
H -4.427157 -1.828784 -2.940941
H -6.432372 -0.610033 -2.049581


