%chk=000231726.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231726

0 1
O -3.687747 -1.097474 -0.148135
O 2.345349 -0.990590 -0.084685
O -1.403058 -0.158674 -2.466859
O -1.446850 -0.533237 2.329259
O -2.566848 3.351336 0.209519
N -1.927933 1.587793 -1.129546
N -1.949837 1.400401 1.269967
C -1.379458 -0.652474 -0.092323
C 0.040629 -1.246983 -0.125778
C -2.426436 -1.793359 -0.190983
C -1.567618 0.229223 -1.333991
C -1.591371 0.026052 1.267542
C 1.134903 -0.181717 -0.032582
C -2.194625 2.202725 0.123218
C -4.848569 -1.975087 -0.227068
C 3.561388 -0.340088 -0.022917
C -6.020608 -1.015132 -0.162890
C 3.737256 1.043104 0.086266
C 4.651440 -1.233258 -0.082400
C 5.046791 1.538957 0.136831
C 5.938309 -0.708990 -0.029843
C 6.141400 0.675951 0.079739
H 0.186707 -1.837307 -1.059718
H 0.170551 -1.975333 0.707708
H -2.332661 -2.343804 -1.145895
H -2.349193 -2.485526 0.668421
H 1.133957 0.513234 -0.890825
H 1.117416 0.371573 0.922978
H -2.097465 2.166798 -1.969682
H -2.135386 1.842214 2.186585
H -4.821524 -2.672879 0.627860
H -4.805128 -2.532055 -1.179142
H -6.977360 -1.546997 -0.212862
H -6.004973 -0.428683 0.766506
H -5.989212 -0.291996 -0.989950
H 2.899596 1.728421 0.131871
H 4.467519 -2.301075 -0.167133
H 5.205515 2.614233 0.221919
H 6.797038 -1.379267 -0.074120
H 7.152698 1.072169 0.119835


%chk=000231726-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231726

0 1
O -3.745192 -1.012039 -0.140311
O 2.409834 -1.093364 -0.097886
O -1.355027 -0.129963 -2.484200
O -1.391694 -0.492093 2.371798
O -2.668669 3.418670 0.212327
N -1.973938 1.617452 -1.103458
N -1.993036 1.440952 1.256452
C -1.373248 -0.599719 -0.077741
C 0.029638 -1.278675 -0.118595
C -2.460361 -1.708438 -0.168487
C -1.560357 0.294251 -1.318483
C -1.577901 0.101488 1.278941
C 1.189601 -0.280256 -0.034791
C -2.251931 2.237889 0.127220
C -4.897800 -1.928590 -0.223206
C 3.647788 -0.425502 -0.034222
C -6.165450 -1.077566 -0.195117
C 3.792971 0.978034 0.091753
C 4.789049 -1.262088 -0.104654
C 5.092719 1.534836 0.146905
C 6.075659 -0.691434 -0.048570
C 6.236835 0.710913 0.077769
H 0.116138 -1.845190 -1.062014
H 0.102627 -1.982466 0.728670
H -2.329559 -2.269762 -1.117143
H -2.356648 -2.393568 0.698687
H 1.171300 0.432889 -0.885483
H 1.166626 0.287380 0.918935
H -2.146083 2.191513 -1.935406
H -2.178297 1.885392 2.161674
H -4.866715 -2.634377 0.635070
H -4.829348 -2.518509 -1.162980
H -7.060995 -1.721991 -0.255308
H -6.218129 -0.491275 0.738228
H -6.180240 -0.376915 -1.047438
H 2.921929 1.637639 0.147315
H 4.644357 -2.342490 -0.201602
H 5.204346 2.620690 0.244359
H 6.955297 -1.342429 -0.103432
H 7.238503 1.150911 0.121123


