%chk=000219952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219952

0 1
O -2.378861 -0.843904 1.980868
N 2.484532 -0.133893 -0.321072
C 1.104943 -0.582803 -0.702890
C 0.094847 0.033015 0.281296
C 2.773963 1.239592 -0.851771
C 3.523737 -1.119933 -0.767133
C -1.337938 -0.371138 -0.076108
C 3.890161 1.879554 -0.008172
C 3.522001 -2.322269 0.192520
C -2.352206 0.164693 0.945354
C 4.172495 3.317846 -0.458977
C 4.621147 -3.326974 -0.173615
C -3.732008 0.323385 0.336886
C 5.282532 3.958791 0.371319
C 4.622194 -4.526551 0.771579
C -4.148395 1.574380 -0.137552
C -4.588498 -0.781225 0.236938
C -5.417676 1.717581 -0.705741
C -5.857400 -0.634047 -0.328886
C -6.273484 0.615362 -0.800818
H 0.838611 -0.324770 -1.749213
H 1.051640 -1.692586 -0.630364
H 0.197512 1.134829 0.295297
H 0.338595 -0.300733 1.312454
H 1.851823 1.856153 -0.765161
H 3.051757 1.239189 -1.926793
H 4.520088 -0.624628 -0.730546
H 3.379110 -1.458221 -1.814611
H -1.600857 -0.018665 -1.091462
H -1.426140 -1.479097 -0.100484
H 4.812787 1.270338 -0.069542
H 3.599558 1.858259 1.061405
H 2.531492 -2.817532 0.184598
H 3.656561 -1.962118 1.232329
H -2.010616 1.114471 1.416978
H 3.250343 3.926398 -0.379582
H 4.453466 3.331073 -1.530192
H 5.611053 -2.830617 -0.145461
H 4.485251 -3.674356 -1.216394
H 6.223644 3.404012 0.283868
H 5.475799 4.987718 0.048781
H 5.021415 3.991118 1.435555
H 3.668465 -5.065736 0.740429
H 5.411961 -5.238615 0.508633
H 4.788233 -4.219626 1.810866
H -3.027745 -0.606970 2.671084
H -3.486798 2.435885 -0.067821
H -4.252652 -1.752516 0.605127
H -5.740184 2.689801 -1.074232
H -6.521450 -1.493460 -0.404062
H -7.261709 0.729541 -1.242108


%chk=000219952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219952

0 1
O -2.188781 -0.215573 2.057244
N 2.529900 -0.063664 -0.343564
C 1.124065 -0.378645 -0.709547
C 0.095330 0.251050 0.253404
C 2.945660 1.296019 -0.776305
C 3.486907 -1.122792 -0.759380
C -1.356321 -0.022370 -0.194308
C 4.050944 1.905963 0.112345
C 3.483377 -2.344215 0.184157
C -2.405252 0.525402 0.794289
C 4.493357 3.307385 -0.367067
C 4.446008 -3.460755 -0.281821
C -3.834585 0.357796 0.286146
C 5.587746 3.927164 0.528792
C 4.445781 -4.681663 0.663367
C -4.546177 1.462224 -0.243476
C -4.463000 -0.914240 0.319658
C -5.858823 1.300999 -0.743554
C -5.775194 -1.076669 -0.175426
C -6.476820 0.029839 -0.711298
H 0.895400 -0.063690 -1.761755
H 0.997471 -1.477356 -0.681700
H 0.259628 1.346557 0.315410
H 0.255645 -0.151969 1.268182
H 2.059821 1.957648 -0.728882
H 3.283316 1.300972 -1.845969
H 4.503785 -0.686599 -0.760773
H 3.290567 -1.463711 -1.809724
H -1.544480 0.430310 -1.188373
H -1.525327 -1.112759 -0.300227
H 4.933526 1.234845 0.135278
H 3.673232 1.959582 1.151898
H 2.458144 -2.759048 0.262978
H 3.758690 -2.002201 1.200666
H -2.207667 1.609120 0.959821
H 3.612148 3.981331 -0.393874
H 4.863481 3.239542 -1.410965
H 5.474580 -3.051353 -0.357402
H 4.165092 -3.784839 -1.305313
H 6.491947 3.289653 0.546982
H 5.887639 4.929247 0.170365
H 5.232570 4.032099 1.571262
H 3.436238 -5.129470 0.730597
H 5.141518 -5.466557 0.313366
H 4.750098 -4.390192 1.686218
H -2.896228 0.045074 2.700534
H -4.072224 2.452197 -0.262818
H -3.917712 -1.765390 0.742922
H -6.399332 2.163355 -1.150053
H -6.252944 -2.062726 -0.144385
H -7.495642 -0.096926 -1.094521


