%chk=000254126.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254126

0 1
S 0.095002 0.580300 1.036935
O -0.635494 -0.533566 1.619078
O 0.344560 1.756408 1.846102
N -0.756989 1.145830 -0.358554
C -1.872107 2.086734 -0.071435
C -1.023519 0.168559 -1.444018
C 1.578737 -0.010238 0.368686
C 2.572498 0.889247 -0.027677
C 1.787783 -1.388491 0.252706
C -3.086144 1.461994 0.565154
C -1.896426 -1.005483 -1.082202
C 3.775493 0.409659 -0.556131
C 2.989469 -1.868913 -0.274533
C 3.981768 -0.968426 -0.679533
C -4.318099 1.929756 0.380670
C -2.530098 -1.733955 -1.997839
H -1.474154 2.888285 0.607302
H -2.140682 2.604990 -1.021718
H -1.466970 0.725173 -2.305814
H -0.036308 -0.205373 -1.813745
H 2.416282 1.967769 0.080420
H 1.012940 -2.091446 0.582331
H -2.889198 0.602464 1.215002
H -1.967656 -1.238194 -0.011374
H 4.551122 1.108714 -0.865443
H 3.154775 -2.941544 -0.364867
H 4.920626 -1.343074 -1.089714
H -5.187308 1.498855 0.857927
H -4.560017 2.771795 -0.250556
H -3.143176 -2.588168 -1.745466
H -2.496112 -1.541463 -3.059696


%chk=000254126-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254126

0 1
S 0.113140 0.322617 1.109688
O -0.506270 -1.073992 1.702248
O 0.270147 1.628267 2.072220
N -0.788950 0.968082 -0.417285
C -1.792699 2.010968 -0.062717
C -1.135589 -0.117961 -1.378810
C 1.791984 -0.101671 0.352126
C 2.645689 0.954852 -0.004644
C 2.128527 -1.459369 0.238337
C -3.142009 1.559336 0.469213
C -2.244525 -1.097978 -1.017598
C 3.914297 0.618111 -0.530041
C 3.402690 -1.774965 -0.290332
C 4.287136 -0.740375 -0.675181
C -4.329231 2.027937 0.013730
C -3.225221 -1.464679 -1.877625
H -1.295140 2.651002 0.693802
H -1.922549 2.625891 -0.975040
H -1.377993 0.397531 -2.328978
H -0.195307 -0.678274 -1.561264
H 2.336543 1.995387 0.133054
H 1.425362 -2.230034 0.571544
H -3.115945 0.859907 1.317802
H -2.168935 -1.556799 -0.022485
H 4.608788 1.413312 -0.820054
H 3.701534 -2.823063 -0.394474
H 5.273011 -0.991748 -1.081057
H -5.278945 1.719353 0.463619
H -4.387669 2.732560 -0.826188
H -3.974478 -2.215706 -1.604025
H -3.316797 -1.020301 -2.877587


