%chk=000206270.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206270

0 1
S -0.700375 0.460737 1.189291
O -1.641661 -0.562202 -2.928820
O 2.929890 1.620818 -1.078151
O -5.308867 -0.358079 0.386897
O -3.855410 -1.416685 1.725506
O 2.582435 -1.856650 -1.864392
N -2.083427 -0.941242 -0.589813
N 1.084995 -0.260169 -1.193626
C -0.862822 -1.099060 0.262002
C -2.309646 1.214224 0.614793
C -3.053893 0.057435 -0.123436
C 0.001960 -1.203901 -1.032768
C -1.305191 -0.823685 -1.821744
C -3.025233 1.711887 1.850825
C -1.966359 2.331680 -0.351285
C -4.031990 -0.680067 0.791627
C 2.352034 -0.690673 -1.597942
C 3.407264 0.425996 -1.724112
C 4.723662 0.029035 -1.043590
C 4.715112 0.760182 0.309071
C 3.548625 1.752313 0.236585
H -0.874574 -1.976425 0.934616
H -3.631638 0.460494 -1.007680
H 0.344773 -2.249849 -1.258263
H -2.500125 2.556908 2.319678
H -4.040402 2.065278 1.617938
H -3.117724 0.940064 2.633094
H -1.293031 3.075719 0.099392
H -1.470818 1.974995 -1.264889
H -2.864459 2.881443 -0.669549
H 0.936957 0.714984 -0.905162
H 3.511538 0.711123 -2.794663
H 5.588089 0.337221 -1.659005
H 4.810078 -1.068867 -0.923727
H 4.583867 0.048408 1.144065
H 5.675388 1.273410 0.490486
H 2.754835 1.549096 0.973299
H 3.855012 2.809722 0.278520
H -6.013369 -0.824017 0.912532


%chk=000206270-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206270

0 1
S -0.724383 0.657972 1.240804
O -1.581309 -0.285497 -2.966737
O 3.083776 1.627810 -1.126553
O -5.328578 -0.443969 0.724399
O -3.607907 -1.755887 1.578163
O 2.658070 -1.936377 -1.939621
N -2.012046 -0.807471 -0.623684
N 1.222001 -0.237545 -1.202883
C -0.817229 -0.967317 0.237945
C -2.481569 1.263198 0.621984
C -3.118562 -0.004540 -0.111819
C 0.063970 -1.075191 -1.067689
C -1.257303 -0.653387 -1.826880
C -3.278695 1.744221 1.849394
C -2.282678 2.399777 -0.403784
C -3.992105 -0.845001 0.817658
C 2.440258 -0.725001 -1.636975
C 3.538908 0.356636 -1.751705
C 4.837582 -0.045464 -1.017373
C 4.608107 0.524078 0.406754
C 3.872095 1.850365 0.125220
H -0.832160 -1.813238 0.935773
H -3.734756 0.351151 -0.954748
H 0.366797 -2.112488 -1.300031
H -2.791625 2.628374 2.296284
H -4.302258 2.034795 1.547456
H -3.342805 0.964603 2.627107
H -1.666756 3.206633 0.028575
H -1.782201 2.043634 -1.320233
H -3.262804 2.828603 -0.690067
H 1.191500 0.760841 -0.957776
H 3.704681 0.553107 -2.826532
H 5.706850 0.440686 -1.494801
H 4.983457 -1.136997 -1.037583
H 3.970925 -0.161003 0.994378
H 5.550225 0.679548 0.958543
H 3.161289 2.143519 0.916572
H 4.579045 2.680863 -0.062046
H -5.886306 -0.982441 1.350115


