%chk=000286467.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286467

0 1
S 2.527566 -1.819397 0.296092
O -4.266392 -1.481995 -0.756173
O -4.006525 1.904864 -1.060928
O -3.016901 -1.348192 1.512309
O -2.946144 2.160896 1.330358
O 2.483427 -2.094526 1.707072
O 3.358026 -2.629309 -0.571530
N 0.935390 -2.156113 -0.370793
N -0.053038 -1.386434 0.129513
C -3.444461 -0.331034 -0.558963
C -4.369682 0.842949 -0.147800
C -2.317136 -0.659308 0.447208
C -4.170126 1.420350 1.263462
C -1.303707 -1.597665 -0.164276
C 2.784626 -0.155984 -0.001272
C 2.186306 0.811259 0.817128
C 3.603696 0.244358 -1.066384
C 3.227697 2.570822 -0.489679
C 2.404880 2.167196 0.576050
C 3.826678 1.597143 -1.311029
C 3.451386 4.020128 -0.758771
H -3.026974 -0.119236 -1.576586
H -5.427465 0.538295 -0.315307
H -1.855792 0.266547 0.878219
H -4.052416 0.628580 2.033570
H -4.997437 2.095371 1.544998
H -1.721836 -2.390460 -0.794930
H -4.407180 -1.950059 0.110218
H -4.798202 2.402999 -1.340935
H -2.376343 -1.793132 2.107282
H 0.751580 -2.966652 -0.980435
H 1.542376 0.505084 1.650418
H 4.075534 -0.510851 -1.707449
H 1.933279 2.912525 1.215055
H 4.464623 1.900959 -2.139069
H -2.846571 2.697977 0.500731
H 2.679739 4.411851 -1.441185
H 3.408109 4.630391 0.154790
H 4.424807 4.218303 -1.229174


%chk=000286467-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286467

0 1
S 2.587811 -1.582751 0.629884
O -4.096824 -1.154990 -1.194191
O -3.321426 2.099750 0.562276
O -3.429745 -1.714730 1.346506
O -4.799121 0.413338 2.182203
O 2.407236 -1.498776 2.242358
O 3.577564 -2.664108 -0.074041
N 0.926120 -1.966541 -0.253369
N -0.126580 -1.266227 0.282882
C -3.250645 -0.154548 -0.543677
C -4.124504 1.070938 -0.132187
C -2.484612 -0.829960 0.639165
C -5.282825 0.782358 0.833501
C -1.356650 -1.697423 0.147173
C 2.942813 0.141691 -0.012512
C 2.613464 1.229815 0.807962
C 3.559617 0.268371 -1.268004
C 3.541275 2.713445 -0.932586
C 2.921260 2.524005 0.329806
C 3.855448 1.571259 -1.719949
C 3.886985 4.104802 -1.430499
H -2.519163 0.184922 -1.303304
H -4.564728 1.474274 -1.068622
H -2.066923 -0.046374 1.299638
H -5.885370 -0.066744 0.477472
H -5.923400 1.679643 0.913525
H -1.627944 -2.648039 -0.346532
H -4.319142 -1.805274 -0.462980
H -2.573295 2.398375 -0.011754
H -4.002826 -1.103668 1.919362
H 0.870312 -3.004976 -0.348252
H 2.152025 1.065949 1.786620
H 3.811685 -0.618972 -1.857262
H 2.679970 3.395363 0.948881
H 4.340019 1.703719 -2.694236
H -4.209912 1.149416 2.491815
H 3.563895 4.249840 -2.477422
H 3.413257 4.887682 -0.814890
H 4.980275 4.273646 -1.402952


