%chk=000292737.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292737

0 1
S 3.185499 -0.123235 -0.148141
O 3.592727 -1.493935 -0.367841
O 3.630306 0.946113 -1.014596
O -3.412325 0.896664 1.023408
O -4.885298 -0.653608 -0.548586
N 3.721916 0.286104 1.430175
N -3.516492 -0.928510 -0.366463
C 1.454956 -0.062396 -0.016026
C 0.782097 1.135399 -0.270352
C 0.746946 -1.212581 0.340895
C -1.318500 0.032610 0.191523
C -0.611498 1.188314 -0.163794
C -0.647388 -1.169494 0.445873
C -2.810811 0.119483 0.314162
H 1.339583 2.033829 -0.561537
H 1.277358 -2.153904 0.528781
H -1.142921 2.125279 -0.344243
H -1.203352 -2.064417 0.732249
H 4.183946 -0.430323 1.986305
H 4.200776 1.174178 1.564703
H -3.197177 -1.236350 -1.288678
H -5.258945 -0.523222 0.391883


%chk=000292737-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292737

0 1
S 3.283256 -0.046360 -0.110362
O 3.724999 -1.567324 -0.487981
O 3.756730 1.268940 -0.943357
O -3.516390 1.193739 0.345430
O -5.024101 -0.906514 -0.111308
N 3.786330 0.221274 1.633860
N -3.596558 -1.034192 -0.117604
C 1.400071 -0.014181 -0.019628
C 0.747676 1.218885 -0.174877
C 0.732621 -1.232330 0.180290
C -1.377724 0.016578 0.068481
C -0.660724 1.225544 -0.124072
C -0.676469 -1.208467 0.227413
C -2.867037 0.109314 0.109197
H 1.321565 2.133976 -0.350940
H 1.297989 -2.163901 0.281743
H -1.226472 2.156260 -0.228198
H -1.212366 -2.143533 0.424443
H 4.328418 -0.600345 1.946533
H 4.309798 1.109623 1.692374
H -3.298083 -1.930378 -0.496962
H -5.122127 0.079390 0.115226


