%chk=000240785.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240785

0 1
O 0.848633 1.040261 0.352446
O -3.054599 -1.691316 -0.830462
N 2.112120 -0.868165 0.141407
N -1.128425 -0.834799 0.147917
N 3.239406 -2.887799 0.101940
N -0.895890 -3.204193 0.157677
N 1.240795 -4.368497 0.115784
C 2.909620 2.865183 0.034045
C 4.192577 3.691853 -0.102331
C 3.217224 1.359358 0.041952
C -4.622302 0.570463 -0.291075
C -5.311475 1.857600 0.174566
C 3.882897 5.196052 -0.112043
C -3.178185 0.492927 0.221604
C 1.948973 0.556230 0.192150
C 1.117302 -1.893806 0.146661
C -6.755571 1.931396 -0.342111
C -0.308601 -1.968159 0.139628
C -2.525832 -0.801010 -0.220832
C 1.841329 -3.149007 0.122789
C 3.375099 -1.571008 0.110478
C 5.154024 6.030019 -0.247080
C -7.453696 3.209509 0.116016
C -0.118771 -4.328753 0.136249
H 2.209267 3.100325 -0.793619
H 2.368119 3.141942 0.962242
H 4.729600 3.417481 -1.031180
H 4.888392 3.461506 0.727761
H 3.921137 1.130370 0.871997
H 3.743867 1.084666 -0.898562
H -5.188653 -0.319311 0.054891
H -4.630219 0.505623 -1.398179
H -4.744685 2.742294 -0.173942
H -5.307952 1.913599 1.280327
H 3.348120 5.478085 0.816611
H 3.190115 5.434123 -0.943529
H -2.601970 1.371225 -0.136724
H -3.164785 0.556075 1.331051
H -7.326142 1.047868 0.006862
H -6.763604 1.876610 -1.448677
H -0.666538 0.057672 0.415520
H 4.321480 -1.039364 0.100049
H 5.847995 5.851351 0.582308
H 4.923990 7.102192 -0.253294
H 5.689821 5.807345 -1.177041
H -7.499775 3.276105 1.208975
H -8.483399 3.252295 -0.257402
H -6.937113 4.105505 -0.246144
H -0.657019 -5.293819 0.139422


%chk=000240785-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240785

0 1
O 0.697844 0.958129 0.085511
O -3.334164 -2.030430 0.115984
N 2.073999 -0.923719 -0.006626
N -1.166789 -1.057161 0.150042
N 3.302144 -2.880141 -0.063480
N -0.804515 -3.422237 0.173423
N 1.412922 -4.457191 0.055641
C 2.774938 2.871017 -0.024882
C 4.053805 3.736660 -0.060722
C 3.105138 1.364959 -0.051485
C -4.590413 0.540269 -0.147932
C -5.178035 1.943622 0.117773
C 3.752074 5.252733 -0.036889
C -3.120489 0.414135 0.297711
C 1.864676 0.481963 0.012748
C 1.122468 -1.999765 0.050921
C -6.651799 2.067095 -0.331572
C -0.304530 -2.150087 0.124431
C -2.589501 -1.024706 0.173033
C 1.915008 -3.193056 0.016242
C 3.355740 -1.559149 -0.073795
C 5.030937 6.116792 -0.062993
C -7.250523 3.464366 -0.061812
C 0.051546 -4.482957 0.137461
H 2.124632 3.121424 -0.884041
H 2.187488 3.103048 0.883251
H 4.642749 3.498791 -0.971586
H 4.701063 3.482724 0.805094
H 3.770353 1.112431 0.799551
H 3.675925 1.121362 -0.970825
H -5.187698 -0.227901 0.377415
H -4.667036 0.300298 -1.226868
H -4.571936 2.713159 -0.405676
H -5.107661 2.176224 1.201564
H 3.160353 5.492263 0.869739
H 3.111194 5.510806 -0.904122
H -2.475738 1.112094 -0.273292
H -3.028337 0.713594 1.363605
H -7.255027 1.296870 0.190358
H -6.722729 1.834623 -1.413734
H -0.682143 -0.139739 0.145245
H 4.275434 -0.982771 -0.126707
H 5.674051 5.901187 0.810959
H 4.788934 7.194857 -0.045511
H 5.625809 5.919411 -0.974650
H -7.226024 3.705018 1.017932
H -8.302269 3.525471 -0.396927
H -6.680511 4.250193 -0.593096
H -0.416657 -5.470479 0.180685


