%chk=000271807.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271807

0 1
O -1.231718 3.058873 1.127379
N -1.904428 -1.489660 -0.373741
N 2.179432 0.395036 -2.144178
C -4.197331 1.456883 -0.115818
C -3.543952 0.214015 -0.779392
C 0.002350 0.599837 0.899021
C -3.171332 2.603075 -0.142384
C -1.381457 0.827437 0.348394
C -2.180415 -0.126569 -0.205882
C -1.854426 2.218354 0.505076
C 0.047591 -0.675945 1.774528
C -5.443254 1.857837 -0.924469
C -4.604208 1.131645 1.328959
C 1.060402 0.576061 -0.158040
C 0.185841 -1.918755 0.955000
C -0.736087 -2.251170 -0.058459
C 2.464460 0.828768 0.087837
C 0.917155 0.318389 -1.510986
C 3.143031 0.704158 -1.172565
C 1.272140 -2.779685 1.183712
C -0.570306 -3.442525 -0.803645
C 3.212428 1.151321 1.234262
C 1.434452 -3.954023 0.449730
C 0.507314 -4.284771 -0.544787
C 4.535912 0.885048 -1.293654
C 4.580860 1.328844 1.112392
C 5.234600 1.195056 -0.140058
H -3.423820 0.404819 -1.867574
H -4.249296 -0.637024 -0.698154
H 0.241132 1.474557 1.580428
H -3.574593 3.503424 0.364538
H -2.967290 2.930188 -1.181086
H -0.871223 -0.728733 2.394921
H 0.887131 -0.585234 2.493574
H -5.200594 2.106905 -1.962275
H -6.190678 1.058102 -0.941629
H -5.928484 2.739199 -0.487991
H -3.744226 0.805870 1.927915
H -5.027045 2.008567 1.832456
H -5.354306 0.336652 1.374241
H -2.619249 -2.028894 -0.872476
H 0.026861 0.090114 -2.066553
H 2.004369 -2.519390 1.949415
H -1.277528 -3.705384 -1.586493
H 2.352137 0.244862 -3.116215
H 2.711826 1.264279 2.193201
H 2.281281 -4.607638 0.646403
H 0.630399 -5.200041 -1.121547
H 5.030611 0.785827 -2.252608
H 5.177444 1.580764 1.985909
H 6.312388 1.344873 -0.182933


%chk=000271807-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271807

0 1
O -1.134559 3.150004 0.916558
N -1.937247 -1.514357 -0.311931
N 2.279746 0.577304 -2.146149
C -4.247663 1.443520 -0.123049
C -3.589928 0.190197 -0.758552
C 0.029151 0.601746 0.876659
C -3.208841 2.589721 -0.211752
C -1.365262 0.835731 0.312028
C -2.206361 -0.147892 -0.196985
C -1.843445 2.232080 0.382521
C 0.128144 -0.706861 1.732717
C -5.519478 1.816794 -0.922634
C -4.634299 1.170079 1.353985
C 1.127469 0.662761 -0.169437
C 0.201911 -1.981606 0.919990
C -0.802144 -2.327682 -0.026913
C 2.538090 0.894205 0.099752
C 1.013503 0.477458 -1.545537
C 3.237360 0.832319 -1.158583
C 1.279441 -2.882766 1.100621
C -0.735679 -3.570730 -0.715150
C 3.278949 1.164805 1.281268
C 1.356555 -4.113267 0.413791
C 0.329986 -4.462931 -0.493651
C 4.633034 1.022553 -1.260338
C 4.671203 1.356167 1.187625
C 5.342065 1.282664 -0.069557
H -3.497257 0.357079 -1.853270
H -4.267905 -0.679027 -0.625816
H 0.196348 1.454130 1.566212
H -3.567947 3.501129 0.299417
H -3.052135 2.860327 -1.277895
H -0.745055 -0.731383 2.415316
H 1.030650 -0.644924 2.367150
H -5.283219 2.025877 -1.983562
H -6.265385 0.999321 -0.891826
H -5.994034 2.720484 -0.497910
H -3.756901 0.885843 1.960955
H -5.080006 2.073932 1.808214
H -5.378916 0.354265 1.420585
H -2.685814 -2.035444 -0.776344
H 0.123630 0.290522 -2.142937
H 2.070064 -2.606214 1.808155
H -1.520797 -3.830363 -1.438138
H 2.468002 0.485029 -3.141170
H 2.774752 1.243155 2.251425
H 2.200654 -4.789231 0.584979
H 0.364330 -5.415506 -1.033361
H 5.152470 0.974685 -2.224309
H 5.252743 1.571809 2.091017
H 6.426327 1.436688 -0.110485


