%chk=000284029.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284029

0 1
S 6.812406 -1.379175 -0.922264
S -0.616065 0.523642 1.124778
O -1.074222 1.005983 -1.416647
N 3.289608 0.474354 0.001739
C 4.271211 -0.633650 -0.225414
C 5.663310 -0.022898 -0.436462
C 1.923548 -0.055082 0.314546
C 1.017216 1.135657 0.614862
C 6.252295 0.570799 0.827538
C -2.931256 0.061819 -0.205323
C -1.559716 0.569164 -0.410803
C -3.987489 0.722142 -0.857167
C -3.190213 -1.050364 0.608301
C -5.298823 0.278398 -0.679703
C -4.506430 -1.491911 0.776075
C -5.558470 -0.827743 0.137894
H 4.275827 -1.287428 0.677875
H 3.989662 -1.285995 -1.080845
H 5.641942 0.740686 -1.247976
H 2.005334 -0.717128 1.207692
H 1.498366 -0.674976 -0.506467
H 3.244349 1.069709 -0.833812
H 0.912622 1.806746 -0.263967
H 1.421511 1.752536 1.444118
H 7.217331 1.060351 0.646215
H 6.403348 -0.176179 1.618546
H 5.567189 1.327840 1.245050
H 6.365986 -1.621462 -2.172139
H -3.775804 1.578150 -1.501315
H -2.376277 -1.582457 1.105497
H -6.119114 0.791738 -1.179966
H -4.710691 -2.355878 1.407520
H -6.583289 -1.173187 0.275223


%chk=000284029-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284029

0 1
S 6.996539 -1.027980 -1.291403
S -0.555390 0.120795 1.624116
O -0.909966 1.037608 -0.932689
N 3.235545 0.345436 -0.080862
C 4.304494 -0.587350 -0.498827
C 5.655050 0.155241 -0.611570
C 1.964932 -0.271010 0.356380
C 1.131428 0.787813 1.100385
C 6.163873 0.686880 0.737178
C -2.911302 0.049138 0.018190
C -1.479440 0.472904 0.035058
C -3.667106 0.334421 -1.152533
C -3.533727 -0.616897 1.106992
C -5.023436 -0.039124 -1.229711
C -4.891656 -0.988581 1.025884
C -5.639435 -0.701235 -0.140700
H 4.400682 -1.378082 0.269215
H 4.082122 -1.101577 -1.466601
H 5.569752 0.983274 -1.339987
H 2.203624 -1.105927 1.041070
H 1.360880 -0.691807 -0.480507
H 3.072044 1.078280 -0.785574
H 0.928360 1.655632 0.449242
H 1.632169 1.119451 2.023107
H 7.075713 1.296216 0.612865
H 6.392724 -0.147709 1.425307
H 5.372947 1.305255 1.195997
H 6.348658 -1.328918 -2.481321
H -3.171380 0.847832 -1.982823
H -2.961685 -0.846027 2.012707
H -5.600688 0.183891 -2.133447
H -5.366917 -1.501896 1.868488
H -6.694207 -0.991749 -0.200427


