%chk=000208282.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208282

0 1
S 1.437282 -0.796342 0.000420
S -1.705545 2.286806 0.000316
O -5.190846 -0.649194 0.000012
O 5.255723 -0.304971 0.000104
O 3.980285 -2.061080 0.000874
N -1.599832 -0.300345 -0.000002
N 4.168920 -0.854049 0.000380
C 0.625997 0.732397 0.000020
C -0.805350 0.756951 0.000031
C 1.525753 1.780876 -0.000257
C -2.954413 0.072285 0.000025
C 2.979719 -0.031978 0.000198
C 2.882201 1.343719 -0.000160
C -3.197443 1.424791 -0.000006
C -4.027116 -0.983637 0.000033
C -3.573630 -2.403987 -0.000175
H 1.256175 2.830402 -0.000525
H 3.734377 2.018158 -0.000356
H -4.166037 1.910229 0.000057
H -2.947098 -2.629847 0.877873
H -2.946141 -2.629373 -0.877656
H -4.423681 -3.101411 -0.000805


%chk=000208282-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208282

0 1
S 1.437034 -0.906328 0.001058
S -1.728432 2.377368 -0.000376
O -5.269355 -0.624621 -0.001016
O 5.358503 -0.158708 -0.001281
O 4.140583 -2.106242 -0.000468
N -1.621675 -0.296426 0.000646
N 4.243186 -0.813678 0.001226
C 0.625593 0.710228 0.000311
C -0.814602 0.756867 0.000232
C 1.549332 1.764926 -0.000112
C -2.975255 0.057931 0.000435
C 3.019614 -0.052330 0.000799
C 2.908420 1.335223 0.000132
C -3.228634 1.429755 -0.000282
C -4.058094 -0.980964 0.000915
C -3.619718 -2.431173 -0.000013
H 1.253996 2.817112 -0.000585
H 3.776746 1.995429 -0.000120
H -4.205287 1.909227 -0.000559
H -2.990493 -2.644182 0.883375
H -2.988822 -2.642742 -0.882554
H -4.503339 -3.086271 -0.001362


