%chk=000230926.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230926

0 1
S 0.548017 1.882504 -0.351492
O 1.651456 1.272511 0.804060
O 1.201281 1.662891 -1.621831
O 0.252734 3.209147 0.112707
N 1.801149 -2.259815 -0.872618
C -0.783139 0.836909 -0.135341
C -2.965093 -0.887318 0.233795
C -0.918485 -0.307505 -0.935046
C -1.746111 1.119845 0.842798
C -2.000379 -1.165289 -0.751977
C -2.831170 0.265191 1.028709
C 2.931155 0.807465 0.372604
C -4.118991 -1.812008 0.422588
C 3.040566 -0.671663 0.780529
C 2.357193 -1.555441 -0.144068
H -0.174560 -0.531336 -1.711498
H -1.651446 2.019983 1.461722
H -2.093155 -2.057139 -1.371706
H -3.575144 0.492374 1.790298
H 3.079503 0.956319 -0.717562
H 3.660814 1.422971 0.936426
H 2.601517 -0.790983 1.804558
H 4.112555 -0.963858 0.870808
H -4.771348 -1.525103 1.258374
H -4.750526 -1.850147 -0.478957
H -3.781796 -2.842003 0.617621


%chk=000230926-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230926

0 1
S 0.552866 1.858306 -0.211429
O 1.748152 0.971899 0.996527
O 1.233688 1.720062 -1.680593
O 0.208694 3.311961 0.402857
N 2.031120 -2.244264 -0.930070
C -0.936066 0.739290 -0.034570
C -3.192316 -0.886815 0.225417
C -0.941261 -0.491859 -0.712135
C -1.991830 1.199847 0.766853
C -2.088763 -1.299108 -0.571308
C -3.127049 0.367546 0.886252
C 3.108129 0.829386 0.463838
C -4.415100 -1.774617 0.356862
C 3.531501 -0.655680 0.593727
C 2.716460 -1.546968 -0.246930
H -0.093645 -0.818803 -1.321248
H -1.931723 2.171693 1.266443
H -2.120109 -2.266687 -1.084424
H -3.969597 0.700065 1.502367
H 3.138928 1.149384 -0.598093
H 3.788756 1.464006 1.060467
H 3.436275 -0.972805 1.648289
H 4.597162 -0.755134 0.309411
H -5.156960 -1.347812 1.052196
H -4.910579 -1.914950 -0.622049
H -4.140136 -2.779443 0.726842


