%chk=000270400.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270400

0 1
S 5.185417 -0.729204 -0.741510
S -0.089463 1.087156 0.657373
O 0.873386 -0.181938 0.099318
O 0.243839 2.230853 -0.159148
O 0.131021 1.140082 2.082761
C 2.302916 -0.111119 0.326511
C 2.917403 0.807732 -0.738153
C 2.754013 -1.573876 0.195854
C 4.421340 0.913966 -0.573248
C 4.241707 -1.717850 0.459020
C -1.634033 0.462836 0.272203
C -2.337167 -0.300602 1.213487
C -2.198898 0.712251 -0.985461
C -4.164981 -0.565417 -0.360459
C -3.595251 -0.812770 0.901812
C -3.456698 0.202299 -1.302564
C -5.503534 -1.125658 -0.702659
H 2.476895 0.274047 1.358005
H 2.449963 1.819322 -0.685636
H 2.652429 0.434727 -1.750166
H 2.485483 -1.954326 -0.812695
H 2.169078 -2.198410 0.902888
H 4.868883 1.552517 -1.360796
H 4.698112 1.363400 0.398427
H 4.508352 -1.417518 1.489250
H 4.573614 -2.767468 0.334290
H -1.901120 -0.490787 2.201538
H -1.654813 1.315952 -1.721582
H -4.136793 -1.405295 1.637372
H -3.890126 0.399052 -2.281821
H -5.401877 -2.123760 -1.158907
H -6.151333 -1.241830 0.177906
H -6.052267 -0.500765 -1.421714


%chk=000270400-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270400

0 1
S 5.493617 -0.787993 -0.489282
S -0.089109 1.273196 0.353275
O 0.922787 -0.165610 -0.304295
O 0.073278 2.563009 -0.615707
O 0.241548 1.399987 1.938918
C 2.339877 -0.143899 0.155133
C 3.167673 0.859143 -0.672876
C 2.798521 -1.609219 0.003935
C 4.644736 0.886759 -0.237417
C 4.244375 -1.803478 0.504994
C -1.772952 0.502646 0.092434
C -2.304909 -0.294846 1.117671
C -2.443389 0.778967 -1.109024
C -4.310312 -0.609383 -0.286025
C -3.588384 -0.846196 0.914702
C -3.724536 0.212795 -1.285321
C -5.674564 -1.236417 -0.503086
H 2.357347 0.140013 1.230084
H 2.736994 1.873078 -0.554898
H 3.093596 0.591196 -1.742848
H 2.725129 -1.906024 -1.058072
H 2.114794 -2.256680 0.586094
H 5.225851 1.599457 -0.845074
H 4.748121 1.166897 0.826625
H 4.340865 -1.522519 1.569406
H 4.564367 -2.851901 0.387044
H -1.747748 -0.458278 2.045408
H -1.988267 1.426346 -1.864990
H -4.034327 -1.467313 1.699612
H -4.275256 0.413710 -2.211096
H -5.577339 -2.223082 -0.996040
H -6.204511 -1.397768 0.451378
H -6.312374 -0.608994 -1.149166


