%chk=000295072.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295072

0 1
O 0.129395 1.242161 0.014010
N -0.891435 -0.851815 -0.015901
N 1.461513 -0.665142 -0.012617
C -2.266938 -0.444197 -0.013543
C -3.263050 -1.452289 -0.137456
C -3.988511 1.266912 0.128523
C -2.634280 0.900434 0.117254
C 2.752311 -0.039482 0.011407
C -4.605599 -1.061061 -0.121233
C -4.975058 0.279834 0.009819
C 3.895312 -0.861273 0.209637
C -2.920522 -2.901168 -0.284981
C 0.222253 0.029604 -0.002309
C -4.357257 2.707832 0.268449
C 2.902677 1.344305 -0.172972
C 5.159472 -0.260395 0.209043
C 3.785899 -2.338519 0.420275
C 4.176496 1.914943 -0.164691
C 5.306481 1.117336 0.023801
H -1.867318 1.678229 0.208682
H -5.384443 -1.818460 -0.214028
H -0.729086 -1.857727 -0.059739
H -6.027278 0.551162 0.018192
H -2.315943 -3.085668 -1.183642
H -2.379955 -3.282440 0.591911
H -3.819950 -3.525948 -0.387049
H 1.463649 -1.684212 0.008751
H -3.977086 3.124423 1.213073
H -3.922317 3.309195 -0.543882
H -5.441106 2.875386 0.252075
H 2.024381 1.983883 -0.318467
H 6.045816 -0.876572 0.357827
H 4.767934 -2.802370 0.594649
H 3.173559 -2.578164 1.300854
H 3.358883 -2.844046 -0.456544
H 4.282315 2.989962 -0.307163
H 6.298187 1.563546 0.028382


%chk=000295072-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295072

0 1
O 0.140941 1.457689 0.060782
N -0.867261 -0.678773 0.030765
N 1.455735 -0.505268 0.058068
C -2.254938 -0.350934 0.019211
C -3.178547 -1.446233 -0.004014
C -4.114375 1.264026 0.018099
C -2.725674 0.985316 0.029811
C 2.776248 0.029762 0.075441
C -4.557578 -1.146176 -0.015473
C -5.030131 0.185733 -0.004812
C 3.859161 -0.908371 0.077547
C -2.700829 -2.889853 -0.016520
C 0.234215 0.196275 0.050760
C -4.596034 2.705136 0.031429
C 3.038724 1.425321 0.090589
C 5.181460 -0.409592 0.095022
C 3.604385 -2.407570 0.060769
C 4.371242 1.887341 0.107705
C 5.451107 0.977603 0.110075
H -1.997339 1.798819 0.046953
H -5.276196 -1.974633 -0.033439
H -0.671385 -1.680861 0.022851
H -6.108085 0.383247 -0.014403
H -2.085265 -3.124133 -0.909901
H -2.105716 -3.146699 0.884512
H -3.560705 -3.579479 -0.035009
H 1.411011 -1.525425 0.050233
H -4.248961 3.234711 0.938466
H -4.205420 3.266162 -0.838054
H -5.697875 2.763555 0.005807
H 2.198940 2.121491 0.088519
H 6.012764 -1.125098 0.096769
H 4.557280 -2.961662 0.066638
H 3.031490 -2.747546 0.948366
H 3.051977 -2.730382 -0.845956
H 4.559926 2.966632 0.119338
H 6.485110 1.338066 0.123453


