%chk=000260811.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260811

0 1
S -0.267444 1.586328 0.672461
O -3.558968 -0.375690 -0.260814
O -0.264223 1.793775 2.106665
O -0.509589 2.737145 -0.190777
N -1.476031 0.437634 0.316447
C 1.177347 0.782928 0.182112
C 2.990680 -0.757632 0.677627
C 3.528970 -0.523101 -0.609306
C 1.815270 -0.098096 1.059711
C 1.710529 1.018783 -1.086781
C -3.088248 -1.782717 -0.136973
C 2.880950 0.367415 -1.479646
C 3.658341 -1.692984 1.633108
C 4.780189 -1.208637 -1.050217
C -2.716068 0.654295 0.007068
C -3.131248 -2.160062 1.332319
C -4.105376 -2.517480 -0.996135
C -3.458188 1.939581 -0.139951
H 1.398283 -0.267224 2.058633
H -2.060453 -1.836580 -0.556987
H 1.219629 1.720152 -1.770261
H 3.293970 0.556004 -2.469260
H 4.684157 -1.367904 1.859637
H 3.128857 -1.764974 2.592973
H 3.717778 -2.710828 1.222334
H 5.626591 -0.952066 -0.395321
H 4.668760 -2.302688 -1.020864
H 5.074805 -0.942576 -2.074032
H -2.929368 -3.225876 1.481737
H -2.378444 -1.596291 1.904423
H -4.107269 -1.937061 1.780764
H -3.928460 -3.598373 -0.983843
H -4.066682 -2.176449 -2.038616
H -5.130955 -2.340858 -0.644387
H -2.812542 2.727607 -0.582296
H -4.351239 1.838831 -0.774530
H -3.796912 2.319268 0.837176


%chk=000260811-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260811

0 1
S -0.329807 1.663384 0.321143
O -3.808611 -0.336822 -0.049927
O -0.340317 2.090056 1.897673
O -0.519447 2.806564 -0.831650
N -1.561758 0.245350 0.045459
C 1.255999 0.726629 -0.035863
C 3.119877 -0.594497 0.788184
C 3.649755 -0.620792 -0.541102
C 1.904805 0.090597 1.032282
C 1.746842 0.733944 -1.347684
C -3.382673 -1.753028 -0.393810
C 2.958534 0.047336 -1.582968
C 3.841939 -1.285101 1.929784
C 4.948857 -1.345977 -0.837119
C -2.829776 0.612763 0.157826
C -3.004268 -2.486403 0.899343
C -4.587232 -2.349050 -1.122806
C -3.409001 1.967918 0.486480
H 1.482995 0.149421 2.041346
H -2.502227 -1.668085 -1.057216
H 1.217963 1.271651 -2.140462
H 3.376304 0.032173 -2.595920
H 4.868452 -0.891271 2.056677
H 3.307143 -1.147073 2.883877
H 3.938857 -2.373012 1.749271
H 5.786504 -0.936656 -0.240607
H 4.878615 -2.421983 -0.586989
H 5.220746 -1.263663 -1.902592
H -2.721353 -3.529131 0.665077
H -2.145938 -1.999515 1.390421
H -3.859590 -2.508102 1.597584
H -4.360702 -3.385070 -1.433154
H -4.834706 -1.761004 -2.022911
H -5.472624 -2.368791 -0.463246
H -3.069478 2.710167 -0.257602
H -4.507148 1.914799 0.494050
H -3.040131 2.305874 1.471351


