%chk=000239648.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239648

0 1
O -2.101216 0.574276 -1.100267
N 0.482846 0.861942 0.233341
N 0.862793 -1.472568 -0.469417
C 1.946665 1.159359 0.276756
C 0.077142 -0.219824 -0.713190
C 2.693955 -0.167567 0.552767
C 2.346298 -1.248314 -0.486504
C -1.423275 -0.569178 -0.468889
C 2.454587 1.817563 -1.026417
C 2.165086 2.134048 1.451181
C -1.824612 -0.745204 0.991353
C 3.032267 -2.579177 -0.154967
C -3.349352 -0.863603 1.112069
C -4.028151 0.194991 0.297807
C -3.393312 0.828503 -0.696819
H 0.175346 0.126139 -1.784685
H 2.404944 -0.532628 1.561434
H 3.782528 0.002899 0.579129
H 2.694802 -0.905269 -1.498250
H -0.074786 1.702054 0.036107
H -1.728264 -1.447690 -1.079273
H 0.604927 -2.181816 -1.164172
H 1.917579 2.745367 -1.245389
H 3.516718 2.070404 -0.952544
H 2.337848 1.158715 -1.891501
H 1.700971 3.107813 1.267006
H 1.722471 1.737211 2.374623
H 3.229403 2.303327 1.635541
H -1.458962 0.113005 1.594501
H -1.305797 -1.629471 1.409569
H 4.113439 -2.450948 -0.042119
H 2.647842 -2.996556 0.786352
H 2.865457 -3.331069 -0.932538
H -3.647128 -0.777600 2.176055
H -3.691102 -1.865441 0.780213
H -5.053090 0.428409 0.561915
H -3.768769 1.626198 -1.329276


%chk=000239648-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239648

0 1
O -2.065010 0.791148 -0.965706
N 0.537221 0.870612 0.263680
N 0.846850 -1.444783 -0.329199
C 1.996800 1.188218 0.259077
C 0.099239 -0.204224 -0.642649
C 2.749065 -0.147986 0.519748
C 2.322454 -1.282477 -0.438026
C -1.412024 -0.457432 -0.461973
C 2.466214 1.850281 -1.074744
C 2.257532 2.165390 1.427751
C -1.862831 -0.779701 0.971163
C 3.009705 -2.613140 -0.088042
C -3.396246 -0.987876 1.016270
C -4.098505 0.101481 0.224042
C -3.428568 0.910016 -0.639642
H 0.244479 0.084112 -1.724270
H 2.525471 -0.475102 1.552821
H 3.839980 0.019459 0.431866
H 2.621577 -0.996691 -1.479618
H -0.047558 1.707113 0.122744
H -1.724573 -1.275121 -1.149215
H 0.515307 -2.226041 -0.915251
H 1.945454 2.814930 -1.225617
H 3.554306 2.050220 -1.057504
H 2.253469 1.213323 -1.951711
H 1.708231 3.115394 1.279318
H 1.918111 1.717408 2.377793
H 3.333597 2.406472 1.508587
H -1.562170 0.055588 1.627280
H -1.311252 -1.671958 1.315304
H 4.108487 -2.515894 -0.156920
H 2.744069 -2.918025 0.939986
H 2.698728 -3.421655 -0.777898
H -3.743763 -0.968983 2.067658
H -3.667243 -1.990848 0.624274
H -5.169443 0.278144 0.371657
H -3.879064 1.746929 -1.181529


