%chk=000255518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255518

0 1
S -1.080431 2.566183 -1.404098
S 0.240882 -1.065637 0.706893
O -2.082179 2.407005 -2.432468
O -0.099500 3.619650 -1.522183
N -0.185457 1.063167 -1.349424
C -0.846034 -0.185714 -1.612432
C 1.131390 1.018558 -0.775912
C -0.703591 -1.263163 -0.757135
C 1.470130 0.059217 0.160943
C -1.328119 -2.518166 -1.021039
C 2.782561 -0.018547 0.714285
C -1.646672 -0.315835 -2.793780
C 2.110999 1.973258 -1.203200
C -2.138109 -2.629938 -2.184545
C 3.741019 0.946469 0.299069
C -1.826877 2.622087 0.144126
C -2.276844 -1.502709 -3.057199
C 3.371125 1.935636 -0.668482
C -1.180959 -3.658850 -0.169802
C 3.172121 -1.013856 1.665608
C -2.794377 -3.868402 -2.466664
C 5.059696 0.908278 0.850151
C -1.162391 3.224990 1.218381
C -3.095824 2.060740 0.328219
C -1.821800 -4.836371 -0.468023
C 4.447204 -1.026964 2.175693
C -2.641813 -4.944052 -1.627680
C 5.403279 -0.053232 1.767573
C -1.765570 3.264041 2.478369
C -3.699583 2.099360 1.587846
C -3.032380 2.698537 2.662315
H -1.757072 0.541318 -3.469726
H 1.837409 2.734847 -1.943529
H -2.895013 -1.608914 -3.950267
H 4.121388 2.663847 -0.981210
H -0.547284 -3.589839 0.715716
H 2.450287 -1.770204 1.977533
H -3.414376 -3.939250 -3.359484
H 5.782934 1.655487 0.525864
H -0.172609 3.672784 1.074172
H -3.621197 1.596096 -0.513897
H -1.710816 -5.707614 0.176564
H 4.748202 -1.784199 2.898776
H -3.137827 -5.890737 -1.834409
H 6.404752 -0.089778 2.192628
H -1.248017 3.730813 3.315559
H -4.686028 1.660539 1.732620
H -3.501629 2.724763 3.647085


%chk=000255518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255518

0 1
S -1.197945 2.549554 -1.126112
S 1.109515 -2.042868 0.023396
O -2.395728 2.414619 -2.276505
O -0.093734 3.792661 -1.249371
N 0.360642 0.476181 -1.828374
C -0.446221 -0.650678 -1.882180
C 1.506919 0.541069 -1.050732
C -0.260247 -1.865862 -1.154524
C 2.008189 -0.479810 -0.185852
C -1.141017 -2.990248 -1.322182
C 3.233599 -0.314652 0.548124
C -1.571053 -0.557662 -2.791059
C 2.255527 1.776708 -1.163136
C -2.253695 -2.855776 -2.243058
C 3.951484 0.938067 0.407322
C -2.168537 2.985590 0.465491
C -2.440258 -1.619830 -2.957271
C 3.428424 1.964352 -0.455666
C -0.976214 -4.232654 -0.621824
C 3.776332 -1.323048 1.414183
C -3.144524 -3.958263 -2.423684
C 5.169451 1.126964 1.130408
C -1.508402 3.714927 1.469508
C -3.501353 2.552629 0.573100
C -1.867169 -5.291104 -0.816831
C 4.967444 -1.106250 2.111434
C -2.961520 -5.156157 -1.725100
C 5.672562 0.128289 1.970427
C -2.229285 4.022973 2.647478
C -4.207181 2.869635 1.757812
C -3.571007 3.596418 2.792284
H -1.704478 0.397936 -3.305938
H 1.827152 2.549870 -1.806620
H -3.289647 -1.531093 -3.643228
H 3.978301 2.907296 -0.546618
H -0.139326 -4.359101 0.073949
H 3.254223 -2.279212 1.531064
H -3.981141 -3.847272 -3.122995
H 5.705478 2.076045 1.015543
H -0.479764 4.056396 1.313561
H -3.973865 2.019259 -0.258335
H -1.725498 -6.231229 -0.273564
H 5.365907 -1.886898 2.767823
H -3.653135 -5.992455 -1.871486
H 6.605882 0.287393 2.520663
H -1.745469 4.598911 3.443948
H -5.250885 2.555232 1.867322
H -4.123737 3.838848 3.706806


