%chk=000297998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297998

0 1
S 0.900792 -0.733731 -0.151800
O 3.100918 0.411047 0.457348
O 1.391865 -0.723026 -1.511969
O 0.974692 -1.936154 0.652355
N 1.712803 0.590668 0.688862
C -0.736996 -0.156964 -0.122193
C -1.675175 -0.782432 0.705081
C -1.118208 0.911691 -0.937609
C 1.534639 0.589573 2.160760
C -2.997201 -0.329967 0.726165
C -2.441033 1.366653 -0.916983
C -3.378170 0.745688 -0.084729
C 3.548830 1.342398 -0.569787
H -1.376247 -1.632494 1.330354
H -0.388628 1.391580 -1.597327
H 2.263742 1.282773 2.620198
H 1.680803 -0.397466 2.636319
H 0.523370 0.964525 2.391521
H -3.729896 -0.816809 1.367977
H -2.740071 2.199572 -1.551459
H -4.410228 1.098523 -0.069608
H 3.323600 2.373066 -0.290746
H 3.099103 1.075282 -1.534524
H 4.627797 1.148105 -0.569005


%chk=000297998-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297998

0 1
S 0.849281 -0.827211 0.033806
O 3.254650 0.792515 0.569888
O 1.509911 -0.869065 -1.467828
O 0.731561 -2.191660 0.945936
N 1.922049 0.788900 1.107572
C -0.903678 -0.133136 -0.122379
C -1.866972 -0.570533 0.801898
C -1.174325 0.770802 -1.163050
C 2.062143 0.186355 2.468865
C -3.179355 -0.057918 0.676314
C -2.492152 1.271919 -1.272806
C -3.487219 0.862660 -0.353175
C 3.322553 1.657396 -0.639589
H -1.602060 -1.307117 1.567802
H -0.391963 1.049664 -1.876249
H 2.640195 0.895131 3.087309
H 2.566093 -0.798317 2.461804
H 1.047643 0.071993 2.883377
H -3.956787 -0.382466 1.375873
H -2.739857 1.974251 -2.075597
H -4.506155 1.254096 -0.445297
H 2.889066 2.646273 -0.413323
H 2.796491 1.162006 -1.470526
H 4.399988 1.735564 -0.851424


