%chk=000288518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288518

0 1
O 2.343110 1.808712 0.959165
O -1.984431 2.752960 2.119748
O -3.964686 -4.074909 1.846824
O -5.243593 -3.269181 0.298723
N -0.432278 2.060813 0.594626
N 1.505019 0.645225 0.877087
N -4.330696 -3.180744 1.102862
C 0.326150 0.933215 -0.027273
C 0.396463 3.272302 0.856312
C 1.633896 2.865668 1.666961
C 0.607989 1.276815 -1.482038
C 2.383876 -0.440551 0.483036
C -1.553388 1.853290 1.422012
C 1.839454 1.784714 -1.910427
C -0.420996 1.067052 -2.414811
C -2.251800 0.523688 1.308273
C 1.904041 -1.536713 -0.255174
C 3.703908 -0.450783 0.975549
C 2.046584 2.068355 -3.264258
C -0.211328 1.355194 -3.764935
C 2.734122 -2.636008 -0.478570
C 4.525174 -1.550297 0.738007
C 4.049239 -2.654365 0.010949
C 1.024268 1.854217 -4.192539
C -1.858060 -0.533561 2.139031
C -3.321239 0.382962 0.414905
C -2.539863 -1.749896 2.077303
C -4.007444 -0.830675 0.346244
C 4.927511 -3.839105 -0.224282
C -3.606651 -1.887686 1.176733
H -0.300365 -0.008600 0.007576
H -0.209735 4.036924 1.397759
H 0.684930 3.709198 -0.126818
H 2.407920 3.652200 1.706247
H 1.380340 2.525088 2.685674
H 2.643438 1.958605 -1.189118
H -1.387604 0.686820 -2.088386
H 0.893175 -1.545155 -0.657559
H 4.074040 0.404684 1.543862
H 3.009445 2.457042 -3.593198
H -1.010735 1.191527 -4.486015
H 2.353303 -3.485833 -1.043820
H 5.543989 -1.552170 1.123299
H 1.187431 2.075315 -5.246115
H -1.022303 -0.407355 2.833388
H -3.625602 1.222401 -0.214612
H -2.252983 -2.590613 2.719895
H -4.850792 -0.964439 -0.340990
H 5.988551 -3.564344 -0.295193
H 4.834370 -4.562022 0.600427
H 4.673636 -4.371286 -1.150845


%chk=000288518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288518

0 1
O 2.407056 1.952133 0.874235
O -2.354313 2.784097 1.582723
O -3.535549 -4.367984 1.870212
O -5.423601 -3.479758 0.947880
N -0.406818 2.020062 0.563621
N 1.575444 0.708930 0.699459
N -4.207879 -3.384551 1.372183
C 0.404843 1.007886 -0.160717
C 0.315955 3.279813 0.843347
C 1.588230 2.926155 1.637706
C 0.681480 1.460819 -1.609197
C 2.411241 -0.426490 0.469010
C -1.681150 1.824626 1.086174
C 1.985213 1.602957 -2.139779
C -0.437457 1.694786 -2.449354
C -2.273735 0.432613 1.083714
C 1.983306 -1.512658 -0.341646
C 3.658655 -0.523894 1.144093
C 2.163557 1.969245 -3.493818
C -0.259085 2.061877 -3.799888
C 2.776647 -2.676365 -0.438323
C 4.442401 -1.685391 1.015776
C 4.017938 -2.792543 0.233181
C 1.046445 2.199632 -4.327449
C -1.578550 -0.679724 1.631418
C -3.621610 0.282625 0.666257
C -2.211226 -1.933480 1.736615
C -4.260097 -0.968208 0.745863
C 4.863592 -4.049591 0.129135
C -3.540179 -2.060850 1.279014
H -0.188953 0.080032 -0.203702
H -0.354595 3.939155 1.418193
H 0.584162 3.774856 -0.107365
H 2.254245 3.798188 1.751249
H 1.332147 2.498721 2.625318
H 2.856829 1.436232 -1.502446
H -1.452122 1.595804 -2.043209
H 1.051242 -1.462900 -0.913190
H 4.001321 0.317634 1.750886
H 3.177462 2.076381 -3.894860
H -1.131781 2.239245 -4.438054
H 2.424446 -3.503936 -1.065865
H 5.404647 -1.735695 1.540538
H 1.189587 2.483230 -5.376000
H -0.552745 -0.558261 1.997345
H -4.163092 1.159523 0.298688
H -1.699626 -2.801357 2.160262
H -5.292835 -1.112767 0.418702
H 5.919000 -3.810506 -0.097734
H 4.856670 -4.619453 1.078484
H 4.492037 -4.722197 -0.663187


