%chk=000208092.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208092

0 1
S -6.323963 0.131200 0.401884
O -2.273562 -1.684505 -0.528821
N 2.467355 0.214969 -0.736595
C 2.959804 -1.086127 -0.200054
C 3.494772 1.308896 -0.774510
C 3.817450 -1.030474 1.077054
C 4.921573 0.828219 -1.080225
C 5.314531 -0.910681 0.766575
C 5.707706 0.452106 0.182621
C 1.241933 0.694055 -0.011309
C 0.037761 -0.153669 -0.454897
C -1.270423 0.391949 0.125535
C -2.426401 -0.556770 -0.107899
C -3.787354 -0.043532 0.212670
C -4.064214 1.207660 0.886351
C -4.922155 -0.739860 -0.109781
C -5.392955 1.442299 1.062031
H 3.536346 -1.563118 -1.025876
H 2.080190 -1.747595 -0.031273
H 3.507746 1.910894 0.160726
H 3.161204 1.990518 -1.592121
H 3.495112 -0.190304 1.719616
H 3.642805 -1.946326 1.673491
H 4.895546 -0.024280 -1.787409
H 5.458140 1.637056 -1.614370
H 5.613651 -1.715465 0.066277
H 5.895978 -1.088746 1.692568
H 5.577109 1.237846 0.952009
H 6.790369 0.442268 -0.053376
H 1.352616 0.659955 1.093126
H 1.059579 1.756802 -0.281406
H 0.173906 -1.213881 -0.152383
H -0.015614 -0.181746 -1.563010
H -1.496842 1.382651 -0.318636
H -1.165766 0.563412 1.217371
H -3.275556 1.872635 1.212199
H -4.977800 -1.698186 -0.608992
H -5.867576 2.287576 1.529238


%chk=000208092-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208092

0 1
S -6.470210 0.120497 0.572824
O -2.414721 -1.646270 -0.811365
N 2.513902 0.179103 -0.668893
C 3.014524 -1.114973 -0.140833
C 3.495442 1.295037 -0.731535
C 3.910689 -1.064010 1.134995
C 4.945389 0.882763 -1.073543
C 5.412480 -0.895163 0.797518
C 5.788628 0.463691 0.158014
C 1.230593 0.633543 -0.084465
C 0.017915 -0.221391 -0.508289
C -1.298535 0.359253 0.038221
C -2.521155 -0.519525 -0.243726
C -3.856314 -0.000079 0.185427
C -4.107488 1.262730 0.860231
C -5.027253 -0.723084 -0.036247
C -5.440898 1.485097 1.141303
H 3.586180 -1.631564 -0.938153
H 2.129673 -1.747461 0.049997
H 3.529851 1.866159 0.233976
H 3.126650 2.006680 -1.498233
H 3.568774 -0.249218 1.806388
H 3.780986 -2.009637 1.698632
H 4.940273 0.085679 -1.842360
H 5.436877 1.759325 -1.540147
H 5.700454 -1.714005 0.104817
H 6.019934 -1.033637 1.714597
H 5.697953 1.263357 0.922831
H 6.858871 0.429135 -0.129867
H 1.271517 0.690771 1.037132
H 1.064826 1.672050 -0.436426
H 0.119155 -1.264036 -0.156857
H -0.016453 -0.273283 -1.611361
H -1.485491 1.368568 -0.384926
H -1.229490 0.506678 1.138260
H -3.324181 1.975502 1.126921
H -5.114620 -1.694468 -0.519982
H -5.911729 2.333886 1.633523


