%chk=000244738.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244738

0 1
O -0.942081 -0.921751 1.827626
O -5.856769 1.290548 -1.423842
N 0.318444 -1.465386 -1.241755
N 1.227219 -2.291422 -1.172421
C 1.593263 -0.831196 0.721710
C 0.333628 -0.451546 -0.127061
C 2.131748 -2.103896 0.003525
C 2.598956 0.286643 0.770386
C -0.971092 -0.523354 0.680513
C 2.925767 0.868618 2.004049
C 3.210692 0.760221 -0.401516
C -2.219099 -0.041570 0.048980
C 3.856734 1.909937 2.064184
C 4.140355 1.800418 -0.336292
C -2.358207 0.163278 -1.332792
C -3.321982 0.193294 0.903308
C 4.465871 2.377246 0.896059
C -3.566674 0.610873 -1.866846
C -4.532676 0.644017 0.398567
C -4.637900 0.847162 -0.991009
H 1.265564 -1.104262 1.759589
H 0.430594 0.570657 -0.569808
H 3.180690 -2.007259 -0.339982
H 2.091364 -3.004017 0.648851
H 2.453513 0.513525 2.919704
H 2.962420 0.316623 -1.364793
H 4.106367 2.357531 3.025340
H 4.613069 2.163124 -1.248010
H -1.524588 -0.036627 -2.013269
H -3.205342 0.010892 1.978137
H 5.190828 3.187522 0.944550
H -3.671537 0.763316 -2.936136
H -5.391278 0.835196 1.039276
H -5.890361 1.410246 -2.407322


%chk=000244738-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244738

0 1
O -1.006109 -1.000339 1.909774
O -5.967255 1.197657 -1.536331
N 0.306157 -1.311655 -1.270558
N 1.207313 -2.211995 -1.170284
C 1.578390 -0.751865 0.786483
C 0.319628 -0.357572 -0.036802
C 2.026559 -2.080687 0.098293
C 2.654724 0.325709 0.791474
C -1.015795 -0.515782 0.736931
C 3.065162 0.925494 2.008647
C 3.264414 0.758284 -0.417299
C -2.274734 -0.067400 0.087195
C 4.059102 1.930696 2.022158
C 4.257450 1.761673 -0.407548
C -2.343271 0.307214 -1.283598
C -3.463516 -0.017364 0.874202
C 4.659159 2.352493 0.813766
C -3.560334 0.728427 -1.849473
C -4.679306 0.406514 0.322362
C -4.726303 0.782750 -1.044187
H 1.256155 -0.958665 1.821221
H 0.373539 0.664671 -0.453334
H 3.092740 -2.098621 -0.186710
H 1.819923 -2.980217 0.706001
H 2.600695 0.603942 2.948898
H 2.964916 0.306651 -1.372561
H 4.363974 2.383100 2.972574
H 4.718246 2.082375 -1.348772
H -1.456296 0.227249 -1.917780
H -3.400610 -0.318299 1.924831
H 5.430230 3.130849 0.822916
H -3.606877 1.004171 -2.910793
H -5.596462 0.455265 0.915968
H -5.914107 1.433875 -2.496166


