%chk=000240663.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240663

0 1
S 2.525427 1.169540 0.705409
O -2.202399 1.276437 1.906888
O 0.887017 -0.436534 -0.632241
N -1.406646 1.136570 -0.228303
C -3.638472 0.272765 0.252189
C -0.081969 1.647719 0.162700
C -2.386821 0.917546 0.758086
C -4.111749 -0.872119 0.907549
C -4.345411 0.817049 -0.827828
C 3.791441 0.046687 0.211586
C 0.992440 0.602557 -0.051015
C -5.289012 -1.482871 0.466625
C -5.524672 0.203888 -1.259948
C -5.993811 -0.946413 -0.616135
C 3.573399 -1.327891 0.125209
C 5.048637 0.609153 -0.030109
C 4.646699 -2.162133 -0.209301
C 6.114052 -0.235815 -0.354364
C 5.913398 -1.618678 -0.444294
H 0.155266 2.563384 -0.435511
H -0.113741 1.983499 1.239355
H -1.456945 0.672065 -1.133275
H -3.565809 -1.276252 1.762044
H -3.985466 1.719576 -1.321881
H -5.659269 -2.374528 0.971194
H -6.079918 0.624452 -2.097188
H -6.912674 -1.423294 -0.956573
H 2.581873 -1.753259 0.297886
H 5.205824 1.686502 0.029959
H 4.490697 -3.237559 -0.285080
H 7.101334 0.184392 -0.540682
H 6.746577 -2.272038 -0.700052


%chk=000240663-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240663

0 1
S 2.688300 0.758200 1.385976
O -2.668499 1.525559 2.056066
O 1.042281 -0.489762 -0.459796
N -1.322259 0.426654 0.534899
C -3.771773 0.278826 0.275178
C -0.110163 0.897901 1.195875
C -2.565635 0.792760 1.018389
C -5.029376 0.411823 0.917522
C -3.712592 -0.305639 -1.017821
C 3.973537 -0.009986 0.306056
C 1.111188 0.268556 0.530291
C -6.205622 -0.045674 0.289284
C -4.891428 -0.760841 -1.647872
C -6.139832 -0.636649 -0.994813
C 3.982573 -1.400739 0.059080
C 4.981705 0.830474 -0.217866
C 5.015638 -1.952904 -0.731717
C 6.018655 0.265357 -0.995501
C 6.035401 -1.124465 -1.255506
H -0.030075 2.002633 1.146052
H -0.124556 0.649549 2.276154
H -1.197236 -0.212423 -0.253759
H -5.052269 0.882048 1.906061
H -2.763305 -0.389320 -1.560610
H -7.171146 0.058195 0.796200
H -4.837272 -1.205003 -2.647772
H -7.053027 -0.991243 -1.485588
H 3.196384 -2.041121 0.468495
H 4.955031 1.907758 -0.025001
H 5.023173 -3.029546 -0.932482
H 6.804236 0.912384 -1.400227
H 6.837258 -1.558965 -1.862348


