%chk=000224679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224679

0 1
S 4.361705 -0.604392 0.594870
O 1.762669 -2.726420 -0.216875
O 3.330907 1.583006 -0.510860
N 1.254799 -0.498483 -0.593510
N 4.664840 1.935745 1.321713
C -2.222489 0.764657 -0.132293
C -2.914992 -0.421294 0.228968
C -0.148439 -0.497738 -0.305255
C -0.822880 0.708828 -0.398133
C -2.186232 -1.649602 0.317164
C -0.841632 -1.696492 0.059325
C -2.950895 1.995617 -0.221231
C -4.318803 -0.358597 0.494737
C -4.297547 2.025173 0.039400
C -4.992194 0.833793 0.402328
C 2.115490 -1.602900 -0.514113
C 3.557526 -1.283978 -0.865441
C 4.036699 1.159358 0.380405
H -0.309704 1.628144 -0.672421
H -2.724157 -2.556735 0.595755
H -0.286630 -2.639224 0.129186
H -2.413908 2.900398 -0.499429
H -4.839149 -1.274720 0.770714
H 1.660615 0.425554 -0.832474
H -4.858370 2.956416 -0.026443
H -6.060081 0.890850 0.602465
H 4.088740 -2.225208 -1.140979
H 3.652042 -0.610616 -1.744909
H 5.243298 1.560988 2.057372
H 4.536271 2.939770 1.317265


%chk=000224679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224679

0 1
S 4.485626 -0.531844 0.668767
O 1.802286 -2.917801 -0.310993
O 3.091867 1.580217 -0.458637
N 1.260987 -0.624812 -0.528680
N 4.643002 2.121863 1.190169
C -2.189512 0.754816 -0.086534
C -2.955027 -0.445190 0.189125
C -0.139009 -0.602274 -0.285589
C -0.784569 0.645227 -0.319617
C -2.266725 -1.702313 0.215392
C -0.895416 -1.795979 -0.014050
C -2.870914 2.018592 -0.115636
C -4.364582 -0.336097 0.424099
C -4.245888 2.093722 0.117354
C -5.001095 0.907339 0.389998
C 2.125944 -1.708364 -0.516169
C 3.583230 -1.322704 -0.807574
C 3.971530 1.238632 0.384036
H -0.206347 1.554931 -0.527568
H -2.840644 -2.613567 0.422514
H -0.375801 -2.755414 0.007471
H -2.294583 2.927965 -0.325145
H -4.938624 -1.247219 0.631952
H 1.717710 0.292881 -0.677105
H -4.755476 3.063461 0.092115
H -6.079085 0.981439 0.570740
H 4.154581 -2.237756 -1.017968
H 3.671157 -0.608572 -1.643391
H 5.379388 1.821049 1.826930
H 4.393487 3.109670 1.141294


