%chk=000200643.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200643

0 1
S -1.268658 2.046026 -0.434528
O -4.128294 0.428577 -1.034929
N -0.209452 -0.408765 0.311774
N -2.421553 -0.243487 0.460788
N -2.110557 -1.529365 0.847718
C 1.195142 -0.176410 0.083502
C -1.274946 0.484899 0.101338
C -0.780576 -1.641531 0.775271
C 1.956774 -1.191374 -0.521561
C 1.775060 1.039744 0.474165
C -3.841111 0.219479 0.321273
C 3.321206 -0.977342 -0.725341
C 3.141500 1.233449 0.252575
C 3.914404 0.230386 -0.340113
H -0.189034 -2.511209 1.032632
H 1.495003 -2.122425 -0.844813
H 1.173108 1.830027 0.930655
H -3.954485 1.153712 0.916000
H -4.533239 -0.595409 0.637567
H 3.924522 -1.755053 -1.194227
H 3.602891 2.177787 0.544754
H 4.978932 0.390651 -0.507373
H -3.638136 1.218436 -1.398225


%chk=000200643-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200643

0 1
S -1.321412 2.098275 -0.499604
O -4.194906 0.510551 -1.035021
N -0.229165 -0.414845 0.304413
N -2.417431 -0.277064 0.416474
N -2.108338 -1.595016 0.808942
C 1.172588 -0.177811 0.082201
C -1.303262 0.484785 0.082113
C -0.776362 -1.634353 0.730218
C 1.956168 -1.207209 -0.493976
C 1.757882 1.056084 0.449134
C -3.809990 0.205913 0.318689
C 3.339036 -1.003950 -0.686311
C 3.140022 1.250859 0.239387
C 3.935213 0.225303 -0.321754
H -0.179665 -2.498438 1.005367
H 1.487664 -2.144126 -0.814455
H 1.139042 1.847323 0.879267
H -3.891589 1.092717 0.977914
H -4.452205 -0.614506 0.665529
H 3.944656 -1.798806 -1.134075
H 3.594990 2.206470 0.519983
H 5.007138 0.384110 -0.479312
H -3.661575 1.304537 -1.326220


