%chk=000256561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256561

0 1
S -1.773594 2.528023 -1.985904
O -5.910386 -1.782114 0.688350
N 2.290318 0.442387 0.315422
N -0.390371 1.433292 -0.015725
C 1.117890 -0.457873 0.561132
C 1.980520 1.435210 -0.768034
C -0.077336 0.405184 1.017831
C 0.782173 2.298982 -0.331572
C 3.522892 -0.283920 0.030655
C -1.543394 1.465546 -0.723014
C 4.714921 0.205515 0.616191
C 3.553186 -1.438609 -0.768662
C -2.661175 0.570047 -0.361364
C 5.912233 -0.490251 0.386850
C 4.729406 1.440765 1.454715
C 4.754273 -2.118009 -0.979160
C 5.934507 -1.643137 -0.400728
C -3.375644 0.771939 0.837232
C -3.064139 -0.428958 -1.258576
C -4.457293 -0.036974 1.153897
C -4.146648 -1.259242 -0.956976
C -4.833360 -1.052578 0.246421
C -6.431884 -2.819358 -0.178747
H 1.392705 -1.169810 1.370954
H 0.830226 -1.063341 -0.325841
H 1.770849 0.953988 -1.748505
H 2.872180 2.085165 -0.910101
H -0.955476 -0.245338 1.220450
H 0.172380 0.929600 1.970220
H 1.034318 2.882569 0.583809
H 0.537477 3.039659 -1.132083
H 2.640302 -1.808078 -1.232330
H 6.837291 -0.125652 0.831808
H 4.876412 2.334923 0.832796
H 3.775154 1.578756 1.989714
H 5.525944 1.426333 2.208615
H 4.770215 -3.014063 -1.596535
H 6.872656 -2.170516 -0.564367
H -3.081986 1.577271 1.512786
H -2.532541 -0.557127 -2.204743
H -5.028389 0.100450 2.069547
H -4.446900 -2.030391 -1.658284
H -5.679572 -3.597194 -0.335298
H -6.778282 -2.387270 -1.122286
H -7.275859 -3.199999 0.411939


%chk=000256561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256561

0 1
S -1.605677 2.314303 -2.124718
O -6.151177 -1.729071 0.746405
N 2.361537 0.229845 0.204544
N -0.364295 1.184305 0.039832
C 1.227963 -0.706311 0.339556
C 2.008680 1.373413 -0.679504
C -0.013125 0.027441 0.903489
C 0.777883 2.114966 -0.124975
C 3.681182 -0.323348 0.075562
C -1.489562 1.257868 -0.760520
C 4.822747 0.457975 0.455102
C 3.872981 -1.659010 -0.377761
C -2.669983 0.425224 -0.376604
C 6.108750 -0.119751 0.322688
C 4.681291 1.846309 1.053936
C 5.164786 -2.215661 -0.483921
C 6.294772 -1.439923 -0.145878
C -3.125832 0.355601 0.973546
C -3.427674 -0.240742 -1.372069
C -4.287858 -0.356672 1.311214
C -4.582615 -0.980133 -1.046333
C -5.016499 -1.038629 0.303259
C -6.959841 -2.425333 -0.259107
H 1.508239 -1.514816 1.037765
H 0.943624 -1.172540 -0.635321
H 1.785412 1.020332 -1.712382
H 2.857326 2.071162 -0.741452
H -0.859090 -0.672358 0.954379
H 0.214031 0.394616 1.923188
H 1.021209 2.536789 0.869869
H 0.468185 2.918353 -0.813127
H 3.007480 -2.263625 -0.668368
H 6.981366 0.474829 0.621319
H 4.685382 2.644720 0.285338
H 3.733586 1.930943 1.615683
H 5.519526 2.058819 1.740101
H 5.285732 -3.244947 -0.840376
H 7.303419 -1.858804 -0.229185
H -2.586689 0.901712 1.755972
H -3.104254 -0.156755 -2.414674
H -4.656557 -0.391904 2.340691
H -5.135491 -1.488908 -1.841387
H -6.374149 -3.213783 -0.770255
H -7.365026 -1.717765 -1.007881
H -7.785493 -2.882935 0.304860


