%chk=000274508.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274508

0 1
S -1.089885 1.971244 -0.049169
O -1.531062 2.944581 -1.033139
O -0.787099 2.422270 1.286527
N 0.946317 0.352861 -0.071593
N 0.362906 1.358701 -0.799800
C 4.394629 -0.553479 -0.970713
C 2.765639 -1.221498 0.478298
C 3.645083 -1.876294 -0.628158
C 4.957756 -0.144797 0.420678
C 3.840709 -0.585103 1.407300
C 3.205886 0.397272 -1.305088
C 2.147755 -0.060762 -0.310287
C -2.163036 0.634115 -0.011441
C -2.013368 -0.365726 0.956699
C -3.197221 0.545005 -0.952101
C -3.937488 -1.535360 0.052335
C -2.895838 -1.446157 0.991283
C -4.082089 -0.531233 -0.922531
C -4.875068 -2.695712 0.077748
H 5.148242 -0.618855 -1.761782
H 2.046976 -1.874764 0.985425
H 4.300227 -2.670252 -0.251863
H 3.068882 -2.290965 -1.463481
H 5.160427 0.933531 0.484573
H 5.906727 -0.659895 0.630472
H 4.209964 -1.316750 2.140272
H 3.433969 0.263586 1.978177
H 2.865437 0.268444 -2.345578
H 3.469126 1.458363 -1.176329
H 0.933121 1.958479 -1.412678
H -1.200909 -0.302555 1.690318
H -3.314320 1.327955 -1.711804
H -2.774214 -2.219487 1.746888
H -4.884509 -0.593754 -1.654687
H -5.876311 -2.436197 -0.293795
H -4.498224 -3.512669 -0.557795
H -5.006437 -3.109344 1.087421


%chk=000274508-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274508

0 1
S -1.033215 1.790136 0.199190
O -1.419700 3.013911 -0.804995
O -0.665173 2.042956 1.763218
N 1.107254 0.053626 0.057412
N 0.423071 0.949112 -0.763969
C 4.572469 -0.463844 -1.089833
C 3.180284 -1.241913 0.557720
C 4.066740 -1.847478 -0.574751
C 5.183393 0.150715 0.209126
C 4.240536 -0.394404 1.347036
C 3.224759 0.261873 -1.389112
C 2.346984 -0.249285 -0.238300
C -2.346548 0.457374 0.107866
C -2.483390 -0.415377 1.197860
C -3.161183 0.411860 -1.033935
C -4.348985 -1.491577 -0.007201
C -3.499654 -1.393512 1.126692
C -4.169989 -0.574577 -1.077732
C -5.418626 -2.565868 -0.081267
H 5.262714 -0.486250 -1.947738
H 2.588998 -1.928889 1.178778
H 4.879031 -2.485298 -0.183892
H 3.489578 -2.411722 -1.328500
H 5.202916 1.254592 0.170853
H 6.223014 -0.194415 0.351449
H 4.791072 -1.048129 2.047432
H 3.765988 0.408262 1.935934
H 2.801148 -0.046433 -2.366332
H 3.322121 1.366776 -1.406177
H 0.961189 1.760283 -1.150291
H -1.830822 -0.317815 2.070770
H -3.023382 1.135235 -1.843823
H -3.634487 -2.088047 1.963730
H -4.828010 -0.630523 -1.952455
H -6.280447 -2.239409 -0.688651
H -5.017844 -3.486997 -0.547097
H -5.789104 -2.840150 0.921586


