%chk=000277791.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277791

0 1
S -1.420395 -0.983067 1.192363
O 1.658465 -3.926976 -1.215161
O 2.782335 -3.298164 0.646968
O 0.319194 0.194900 -1.630826
N 1.381696 -0.774870 0.145175
C -0.310297 -2.442384 0.999918
C 0.745222 -2.080602 -0.084607
C 0.288355 -2.606534 2.388221
C -1.106256 -3.660618 0.567605
C 1.863850 -3.128779 -0.116482
C -2.307039 -0.809102 -0.394023
C 1.012114 0.331268 -0.635698
C -2.957537 0.531969 -0.298116
C 1.581622 1.630071 -0.158471
C -2.423245 1.621316 -1.005724
C -4.102571 0.711840 0.494699
C 2.935246 1.925410 -0.360906
C 0.732304 2.552611 0.465498
C 2.622749 -4.989138 -1.449470
C -3.030498 2.875659 -0.920179
C -4.703431 1.970736 0.577280
C -4.170433 3.053692 -0.129008
C 3.441677 3.155685 0.067599
C 1.247718 3.779451 0.893470
C 2.599381 4.080411 0.694813
H 0.243691 -2.064399 -1.104415
H 0.736817 -1.682262 2.777745
H -0.465363 -2.923928 3.123083
H 1.085566 -3.366274 2.401461
H -1.932707 -3.872324 1.261143
H -1.545996 -3.553981 -0.432117
H -0.479195 -4.563560 0.538388
H 1.863846 -0.655652 1.035846
H -3.041652 -1.624651 -0.519137
H -1.595176 -0.863187 -1.248722
H -1.530891 1.481767 -1.625912
H -4.520464 -0.126348 1.049785
H 3.587086 1.203921 -0.853603
H -0.324767 2.314512 0.613087
H 2.628762 -5.675648 -0.597784
H 2.238046 -5.462817 -2.359058
H 3.614872 -4.553179 -1.604519
H -2.615320 3.716055 -1.474226
H -5.589942 2.107360 1.193980
H -4.642200 4.031557 -0.064803
H 4.492663 3.394007 -0.088874
H 0.593132 4.501253 1.380367
H 2.997368 5.038392 1.028047


%chk=000277791-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277791

0 1
S -1.536124 -0.897823 1.378087
O 1.402267 -3.768009 -1.392844
O 2.867619 -3.081720 0.281069
O 0.255070 0.688335 -1.255202
N 1.462045 -0.622626 0.242161
C -0.261769 -2.309509 1.069302
C 0.740890 -1.856466 -0.067498
C 0.444964 -2.471597 2.434135
C -0.992040 -3.606974 0.666105
C 1.789158 -2.943369 -0.345854
C -2.495435 -0.825031 -0.282014
C 1.189321 0.575858 -0.396100
C -3.428916 0.363212 -0.255422
C 2.057064 1.743360 -0.007370
C -2.996420 1.618130 -0.760024
C -4.742021 0.246429 0.269287
C 3.381362 1.592567 0.482124
C 1.521420 3.045631 -0.172473
C 2.343956 -4.866470 -1.736125
C -3.867308 2.730145 -0.747215
C -5.611752 1.359852 0.284563
C -5.176557 2.605506 -0.224957
C 4.149777 2.729581 0.815040
C 2.286465 4.179785 0.168666
C 3.602221 4.024942 0.666430
H 0.167360 -1.680748 -0.993015
H 0.884278 -1.519281 2.781550
H -0.282477 -2.801921 3.195569
H 1.251400 -3.224707 2.370987
H -1.789525 -3.824462 1.396971
H -1.445870 -3.529242 -0.337197
H -0.294930 -4.466131 0.648043
H 2.202745 -0.678642 0.943202
H -3.044101 -1.774362 -0.392300
H -1.738718 -0.705461 -1.073265
H -1.978892 1.704051 -1.159422
H -5.080540 -0.718922 0.665507
H 3.838858 0.599015 0.568105
H 0.506587 3.142871 -0.570959
H 2.484273 -5.533247 -0.868976
H 1.863777 -5.392974 -2.571871
H 3.318690 -4.446377 -2.034164
H -3.527631 3.692796 -1.146641
H -6.625072 1.256724 0.689419
H -5.851532 3.469088 -0.216899
H 5.174897 2.605855 1.180825
H 1.860892 5.181798 0.047053
H 4.198677 4.905939 0.928307


