%chk=000299240.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299240

0 1
S 1.989358 0.767876 -1.886474
O -2.317987 -1.581932 0.246488
O -0.037119 -1.568545 0.387528
O 1.155719 0.755550 0.650046
N 3.015310 -0.453427 0.296239
C -1.211194 -0.845061 0.819417
C -1.211438 0.574889 0.288606
C -1.862418 -2.261646 -0.950094
C -0.328368 -2.221747 -0.874372
C -1.302209 -0.942374 2.327355
C -0.040829 1.331150 0.155025
C -2.420443 1.189478 -0.068592
C -0.025248 2.647492 -0.313697
C -2.437395 2.504774 -0.539253
C -1.245531 3.230497 -0.662717
C 2.072596 0.324081 -0.283046
C 2.865858 -0.918759 1.694455
C 4.186451 -0.933529 -0.469056
H -2.274917 -1.714943 -1.813427
H -2.297807 -3.270541 -0.880563
H 0.152809 -3.207652 -0.794215
H 0.139190 -1.617324 -1.672986
H -1.160445 -1.980618 2.658387
H -0.539332 -0.320738 2.812597
H -2.289377 -0.615759 2.680891
H -3.347958 0.617227 0.016456
H 0.915778 3.186985 -0.417081
H -3.383090 2.966974 -0.817372
H -1.266798 4.253531 -1.038013
H 3.203316 -0.143844 2.403514
H 3.436758 -1.842570 1.870176
H 1.792906 -1.135694 1.901366
H 3.993016 -1.937463 -0.887726
H 5.077178 -0.974778 0.178434
H 4.417561 -0.258357 -1.319697


%chk=000299240-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299240

0 1
S 2.056663 0.447881 -1.959816
O -2.472937 -1.621931 0.348331
O -0.158358 -1.763717 0.132960
O 1.205386 0.711368 0.656410
N 3.154272 -0.412005 0.425941
C -1.216651 -0.948951 0.755215
C -1.203545 0.503999 0.238005
C -2.219559 -2.248170 -0.977466
C -0.688905 -2.092758 -1.211457
C -1.086621 -1.047535 2.271791
C -0.018026 1.277068 0.180634
C -2.413832 1.135048 -0.141992
C -0.018255 2.618858 -0.243308
C -2.434795 2.479846 -0.571420
C -1.234708 3.225319 -0.622404
C 2.159690 0.222973 -0.265438
C 3.054141 -0.629386 1.887487
C 4.296707 -1.027067 -0.268767
H -2.809444 -1.730106 -1.755712
H -2.541871 -3.299951 -0.898720
H -0.189364 -3.019785 -1.530318
H -0.452915 -1.273017 -1.914811
H -1.062711 -2.109561 2.565187
H -0.163931 -0.545984 2.605709
H -1.949771 -0.558257 2.752586
H -3.334839 0.545493 -0.090555
H 0.928010 3.165810 -0.281077
H -3.383191 2.944164 -0.862757
H -1.242102 4.268161 -0.956970
H 2.871901 0.321168 2.414308
H 4.002797 -1.064208 2.240548
H 2.225590 -1.322794 2.118407
H 4.273054 -2.126862 -0.148179
H 5.245679 -0.639903 0.146199
H 4.236343 -0.782007 -1.339955


