%chk=000260878.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260878

0 1
S -1.960528 0.265730 -0.742362
O 3.573810 -1.613070 -0.942665
O 2.534460 2.666099 2.167447
N 0.674946 -0.524121 -0.711837
N 0.230031 1.324755 0.568929
N 4.178342 -0.055463 0.598606
N 3.952330 1.231665 1.148680
C -2.687828 1.880399 -0.206186
C -3.921113 2.052782 -1.091923
C -3.026745 1.807244 1.278629
C -4.689220 3.315102 -0.663016
C -3.806059 3.063791 1.698986
C -5.052762 3.268199 0.827537
C -0.298974 0.373589 -0.255606
C 1.873703 -0.118319 -0.126900
C 0.503727 -1.711154 -1.575184
C 1.575619 1.027837 0.650907
C 0.222567 -2.944374 -0.750009
C 3.219526 -0.667112 -0.259889
C 2.619894 1.719538 1.419887
C 1.292187 -3.730454 -0.297278
C -1.095854 -3.309285 -0.445804
C 1.040203 -4.880261 0.454813
C -1.341057 -4.460935 0.307798
C -0.275439 -5.246954 0.757824
H -1.942688 2.690782 -0.394725
H -4.594563 1.174874 -1.016672
H -3.635377 2.134644 -2.159011
H -2.096862 1.725927 1.881848
H -3.623055 0.903353 1.509937
H -5.605513 3.417384 -1.274082
H -4.078778 4.215092 -0.872529
H -3.147368 3.951968 1.631956
H -4.095714 2.981725 2.763452
H -5.566701 4.203354 1.118940
H -5.776287 2.450880 1.011776
H 1.444820 -1.850988 -2.173128
H -0.314573 -1.517377 -2.310363
H 5.168693 -0.191725 0.331729
H 4.652514 1.456597 1.878013
H 2.322249 -3.441136 -0.531341
H -1.931179 -2.699077 -0.788189
H 1.871280 -5.490441 0.806044
H -2.365217 -4.743942 0.546050
H -0.469547 -6.143224 1.344810


%chk=000260878-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260878

0 1
S -1.998900 0.151894 -0.886355
O 3.643629 -1.612685 -0.894406
O 2.307209 2.911940 2.054303
N 0.708107 -0.558542 -0.697856
N 0.157216 1.336345 0.467165
N 4.142267 0.168459 0.516045
N 3.797482 1.329600 1.246655
C -2.730166 1.820589 -0.238092
C -3.963034 2.134874 -1.105679
C -3.063135 1.728512 1.261237
C -4.628049 3.450436 -0.618644
C -3.730445 3.048407 1.733636
C -4.979766 3.384881 0.886572
C -0.303412 0.334002 -0.319088
C 1.883211 -0.084019 -0.107384
C 0.555974 -1.782708 -1.538346
C 1.518905 1.082328 0.600110
C 0.257268 -3.046424 -0.734768
C 3.238983 -0.604401 -0.222532
C 2.496877 1.873739 1.358865
C 1.322927 -3.875125 -0.298967
C -1.077956 -3.413573 -0.429206
C 1.053655 -5.049649 0.438688
C -1.345271 -4.587385 0.310154
C -0.279478 -5.408267 0.746334
H -1.920271 2.552463 -0.405176
H -4.696910 1.306684 -1.026029
H -3.674104 2.220268 -2.169753
H -2.138900 1.537901 1.833235
H -3.755755 0.880391 1.432455
H -5.534336 3.647837 -1.222627
H -3.933171 4.296813 -0.795402
H -2.996688 3.876327 1.657605
H -3.998318 2.958350 2.803488
H -5.418554 4.346223 1.216110
H -5.753006 2.605348 1.048092
H 1.501141 -1.897547 -2.092592
H -0.257940 -1.567837 -2.254142
H 5.134384 -0.074245 0.466836
H 4.548836 1.780722 1.773465
H 2.353381 -3.588859 -0.539578
H -1.907197 -2.780412 -0.766086
H 1.882174 -5.686041 0.769414
H -2.380309 -4.862844 0.541450
H -0.486653 -6.320871 1.316694


