%chk=000210317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210317

0 1
S 5.541449 1.202138 -0.755352
S 6.230700 0.346412 0.983938
O -9.576277 -0.089351 0.493953
O 6.453499 -1.207784 0.401595
O 7.533173 0.843223 1.276305
O 5.177936 0.278274 1.939686
N 1.642566 0.036970 -0.599639
C -3.338583 -0.326675 -0.291727
C -2.103611 0.497418 0.097083
C -4.631124 0.334252 0.205708
C -0.813497 -0.163805 -0.403170
C -5.866029 -0.489516 -0.183921
C 0.418911 0.667184 -0.011269
C -7.156434 0.169451 0.314575
C 2.892881 0.730183 -0.155346
C -8.386034 -0.654409 -0.076205
C 4.006524 0.282258 -1.099870
H -3.254658 -1.349778 0.123401
H -3.377038 -0.450129 -1.391555
H -2.189010 1.520375 -0.318842
H -2.064818 0.620239 1.196978
H -4.714431 1.357741 -0.208331
H -4.592563 0.456778 1.305709
H -0.845318 -0.279737 -1.506004
H -0.730921 -1.189884 0.003554
H -5.780494 -1.512643 0.232510
H -5.903951 -0.612092 -1.284030
H 0.473489 0.775441 1.093790
H 0.331781 1.694443 -0.431149
H -7.242285 1.196879 -0.086988
H -7.130770 0.284634 1.417363
H 1.687005 -0.951839 -0.325816
H 2.744459 1.831884 -0.227686
H 3.157692 0.516447 0.908830
H -8.512683 -0.727522 -1.170404
H -8.370519 -1.669893 0.363608
H 3.738448 0.504560 -2.157897
H 4.185696 -0.810572 -1.053242
H -9.707289 0.825834 0.182192
H 7.313726 -1.627884 0.570462


%chk=000210317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210317

0 1
S 5.652532 1.229612 -1.015375
S 6.428423 0.153605 1.100045
O -9.746957 -0.219323 0.460601
O 6.486004 -1.637368 0.553537
O 7.918951 0.623909 1.506273
O 5.227306 0.129138 2.175295
N 1.680621 0.185329 -0.482166
C -3.361501 -0.274719 -0.276535
C -2.125617 0.565191 0.117197
C -4.691958 0.324360 0.231501
C -0.798284 -0.047923 -0.381730
C -5.927879 -0.509336 -0.175610
C 0.428014 0.811934 -0.018522
C -7.258064 0.084398 0.342208
C 2.925615 0.948107 -0.307072
C -8.482051 -0.750171 -0.075714
C 4.049819 0.251635 -1.088967
H -3.247650 -1.304320 0.122570
H -3.400866 -0.371947 -1.381576
H -2.235636 1.590597 -0.293520
H -2.092285 0.673082 1.221261
H -4.802515 1.357788 -0.158776
H -4.657336 0.411648 1.337325
H -0.829039 -0.178282 -1.480954
H -0.679401 -1.062009 0.055896
H -5.814247 -1.543940 0.209972
H -5.963432 -0.592599 -1.282357
H 0.439463 0.996219 1.084039
H 0.345788 1.805122 -0.503167
H -7.370860 1.121523 -0.041319
H -7.237729 0.153526 1.447438
H 1.763462 -0.803439 -0.210057
H 2.769277 1.965889 -0.713084
H 3.236334 1.061232 0.757956
H -8.528372 -0.834060 -1.184149
H -8.418402 -1.768961 0.343680
H 3.797763 0.147952 -2.161741
H 4.259985 -0.761324 -0.696140
H -9.866298 0.708066 0.133045
H 7.368620 -1.780636 0.101487


