%chk=000298565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298565

0 1
S 2.425701 0.707025 0.006021
O 2.803779 0.053875 1.240809
O 2.734702 0.097029 -1.276815
N 3.210001 2.244485 0.009560
C -0.247349 0.156955 0.006182
C 0.735427 1.064643 0.041580
C -1.672135 0.590652 0.057994
C -0.057535 -1.311315 -0.076822
C -2.138038 1.356174 1.137376
C 0.648581 -1.892792 -1.139931
C -2.548868 0.229520 -0.976342
C -0.621308 -2.128607 0.918479
C 3.140940 3.011049 1.272326
C 3.058891 3.058742 -1.215670
C -3.475461 1.759362 1.178307
C 0.786007 -3.282543 -1.206525
C -3.882543 0.643760 -0.933585
C -0.472149 -3.514788 0.850480
C -4.347162 1.407082 0.142747
C 0.228894 -4.093528 -0.213931
H 0.473637 2.124722 0.096121
H -1.459534 1.628476 1.945157
H 1.117091 -1.263343 -1.907064
H -2.188234 -0.374161 -1.809761
H -1.167402 -1.678415 1.747030
H 3.933390 3.780811 1.281512
H 3.351903 2.333025 2.123995
H 2.177456 3.514309 1.445964
H 2.082877 3.559148 -1.310933
H 3.221166 2.415396 -2.103956
H 3.844003 3.835360 -1.243578
H -3.838645 2.349103 2.018821
H 1.342391 -3.728764 -2.030256
H -4.561923 0.367538 -1.739078
H -0.898798 -4.145609 1.628391
H -5.388284 1.725004 0.175358
H 0.345032 -5.175180 -0.264566


%chk=000298565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298565

0 1
S 2.526855 0.697798 -0.390751
O 2.942435 -0.313714 0.809279
O 3.013317 0.442809 -1.926395
N 3.273912 2.356498 0.082869
C -0.302308 0.078925 -0.178206
C 0.673551 1.016147 -0.376747
C -1.701982 0.587244 -0.005384
C -0.071860 -1.393119 -0.169992
C -1.962441 1.771209 0.739450
C 0.821851 -2.001902 -1.093955
C -2.795266 -0.096683 -0.605594
C -0.765980 -2.214405 0.761363
C 2.961996 2.732985 1.475614
C 3.082870 3.386083 -0.956436
C -3.277331 2.266555 0.866674
C 1.025882 -3.396824 -1.071241
C -4.108485 0.403484 -0.481796
C -0.550393 -3.607155 0.787965
C -4.355216 1.587581 0.252057
C 0.346638 -4.203555 -0.129542
H 0.477027 2.081595 -0.532609
H -1.135342 2.278706 1.249186
H 1.345237 -1.389979 -1.837896
H -2.608333 -1.009756 -1.180311
H -1.456520 -1.754711 1.476863
H 3.715646 3.475932 1.795494
H 3.067264 1.843085 2.118613
H 1.948950 3.176906 1.612766
H 2.093526 3.899215 -0.917565
H 3.223842 2.923073 -1.947682
H 3.871470 4.149323 -0.821833
H -3.463574 3.172282 1.454173
H 1.718085 -3.851889 -1.787478
H -4.938656 -0.128425 -0.959145
H -1.076693 -4.225757 1.522976
H -5.376547 1.971055 0.351981
H 0.513073 -5.286415 -0.111368


