%chk=000268131.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268131

0 1
O -2.729280 -1.276414 1.236637
N 4.002348 -0.021760 -0.163741
N 0.360479 -0.177390 -1.048020
C 2.621066 0.507873 -0.400731
C 4.758584 0.824286 0.818261
C 4.752773 -0.160809 -1.457486
C 1.710551 -0.691077 -0.752540
C 4.224072 0.590393 2.232310
C 5.915889 -1.138787 -1.283294
C -0.640715 -0.543769 -0.313641
C -1.996121 -0.038907 -0.609421
C -3.089301 -0.429454 0.209796
C -2.259528 0.822732 -1.681039
C -4.390953 0.022532 -0.031819
C -3.557898 1.282246 -1.933724
C -4.613277 0.882803 -1.112874
C -3.768123 -1.743639 2.130753
H 2.569037 1.275432 -1.202139
H 2.238976 0.997135 0.521571
H 5.829935 0.522317 0.781098
H 4.725186 1.906839 0.569446
H 4.053486 -0.561733 -2.226014
H 5.123785 0.811554 -1.847108
H 2.078461 -1.195770 -1.676527
H 1.763659 -1.450688 0.058135
H 3.204028 0.972532 2.353946
H 4.191709 -0.483161 2.463257
H 4.858427 1.078236 2.978511
H 6.697042 -0.735479 -0.629236
H 5.571114 -2.076372 -0.825810
H 6.373880 -1.381080 -2.247155
H -0.594919 -1.229609 0.552854
H -1.430924 1.135451 -2.325086
H -5.220961 -0.279001 0.596973
H -3.739278 1.950627 -2.771855
H -5.623514 1.241390 -1.311091
H -4.510061 -2.327745 1.578744
H -4.221138 -0.900472 2.660033
H -3.198595 -2.381060 2.819828


%chk=000268131-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268131

0 1
O -2.795555 -1.233437 1.331119
N 4.048898 0.043305 -0.181153
N 0.372609 -0.203337 -1.066011
C 2.647941 0.491869 -0.378496
C 4.774995 0.811546 0.864003
C 4.795854 -0.058414 -1.463623
C 1.706887 -0.701240 -0.685961
C 4.339470 0.432208 2.292581
C 5.956293 -1.070736 -1.409654
C -0.648211 -0.533473 -0.317189
C -2.016470 -0.065124 -0.619633
C -3.113061 -0.428726 0.223532
C -2.278340 0.749634 -1.751504
C -4.426337 0.013861 -0.069556
C -3.581369 1.194966 -2.048709
C -4.654047 0.823749 -1.204160
C -3.885632 -1.635858 2.222031
H 2.555618 1.237665 -1.202976
H 2.290309 0.990897 0.539886
H 5.852868 0.591097 0.756943
H 4.662268 1.915879 0.714535
H 4.081443 -0.384853 -2.242500
H 5.179583 0.941490 -1.792072
H 2.121131 -1.257503 -1.550042
H 1.700936 -1.388413 0.190892
H 3.266228 0.635241 2.461424
H 4.512755 -0.643942 2.467297
H 4.912313 1.012349 3.040409
H 6.719068 -0.785150 -0.662865
H 5.574190 -2.070440 -1.138910
H 6.459262 -1.135455 -2.392863
H -0.543338 -1.181256 0.575797
H -1.422747 1.013496 -2.381873
H -5.267920 -0.263149 0.571842
H -3.763473 1.822695 -2.927145
H -5.672353 1.162977 -1.425455
H -4.642745 -2.239669 1.685169
H -4.372027 -0.756117 2.686282
H -3.407393 -2.248430 3.000412


