%chk=000276796.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276796

0 1
S -3.769806 1.399670 -0.261440
S -4.666055 -2.797222 -1.417630
O -4.040354 2.362104 -1.307867
O -4.498135 1.442284 0.972945
O 4.899802 2.173901 -1.067490
N -4.206770 -0.083743 -1.111128
N 2.833181 0.298435 0.313793
N 6.031224 0.144920 -0.850353
N 2.066229 1.171224 0.755082
N 5.942816 -1.030754 -0.110149
N 4.641394 -1.803134 1.783128
N -3.331210 -1.639788 0.510274
C -2.083944 1.278925 0.010722
C 4.260383 0.475657 0.661140
C -1.600286 0.674117 1.177925
C -1.190648 1.803011 -0.935707
C 0.656718 1.110774 0.449022
C 4.949075 -0.895488 0.766696
C -0.224741 0.584217 1.405663
C 0.183855 1.721250 -0.727961
C 5.042659 1.105313 -0.538546
C -4.012757 -1.342823 -0.597357
C -3.967430 -3.803423 -0.177794
C -3.319158 -3.032288 0.739014
H 4.461207 1.090195 1.581387
H -2.300928 0.261397 1.919286
H -1.573339 2.286203 -1.844517
H 0.151366 0.115989 2.313828
H 0.883237 2.128802 -1.459320
H -4.731820 -0.010003 -1.995863
H 6.711918 0.179558 -1.603053
H 5.091523 -2.712362 1.699945
H 3.653067 -1.886098 1.997168
H -4.077528 -4.872349 -0.198730
H -2.794847 -3.377571 1.626687


%chk=000276796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276796

0 1
S -3.340809 0.714252 -1.127945
S -6.442504 -2.289819 -0.570914
O -3.299030 1.288578 -2.653295
O -4.263174 1.392250 0.025077
O 4.717080 2.725456 1.889088
N -3.853223 -1.272459 -1.298311
N 3.327170 0.518330 0.158389
N 6.456304 1.834098 0.533072
N 2.350526 0.219388 0.967025
N 6.768196 0.664923 -0.243141
N 5.617189 -1.371882 -0.691059
N -4.297321 -1.819944 0.993416
C -1.568856 0.548876 -0.509569
C 4.635702 0.408282 0.828836
C -1.361795 0.024029 0.776226
C -0.543942 0.980846 -1.371932
C 1.037737 0.362844 0.387568
C 5.718279 -0.139663 -0.093666
C -0.027112 -0.061789 1.223738
C 0.781321 0.890501 -0.908755
C 5.230622 1.832343 1.173955
C -4.660873 -1.737218 -0.290239
C -6.501678 -2.660966 1.172638
C -5.308892 -2.315820 1.801445
H 4.558176 -0.156240 1.780935
H -2.201547 -0.324102 1.386098
H -0.787568 1.380017 -2.361739
H 0.212284 -0.457274 2.215439
H 1.621992 1.221478 -1.525316
H -4.244474 -1.323191 -2.255575
H 7.137110 2.590976 0.548624
H 6.359964 -1.691269 -1.310159
H 4.745281 -1.891549 -0.650376
H -7.381634 -3.127466 1.610392
H -5.120603 -2.435918 2.868830


