%chk=000203413.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203413

0 1
O -0.178588 0.195101 -1.998930
N 3.337476 0.693791 0.294267
C 0.893377 0.924153 -0.032347
C -0.377460 0.191120 -0.568495
C 2.170267 0.178594 -0.495736
C -0.450165 -1.256913 -0.079117
C -1.689246 0.895577 -0.220284
C 0.922820 2.375119 -0.515875
C 4.585582 0.697099 -0.540141
C -0.771826 -1.544133 1.254585
C -1.854795 1.561430 1.002664
C -0.177023 -2.310782 -0.962880
C -2.762636 0.850702 -1.122414
C 3.518898 -0.103111 1.543569
C 5.680442 1.519260 0.142122
C -0.830398 -2.869844 1.694274
C -3.071952 2.174574 1.313543
C -0.238588 -3.635174 -0.522276
C -3.978401 1.464391 -0.812100
C -0.566835 -3.918013 0.807292
C -4.136435 2.128012 0.408439
H 0.851413 0.908174 1.084369
H 2.038959 -0.919486 -0.397626
H 2.312865 0.370042 -1.582223
H 1.876065 2.847393 -0.239421
H 0.829612 2.426199 -1.608724
H 0.114717 2.974852 -0.088272
H -0.993628 -0.082485 -2.471751
H 4.960490 -0.325023 -0.762479
H 4.335316 1.168953 -1.517696
H -0.985279 -0.738123 1.955155
H -1.032158 1.613378 1.716213
H 0.098411 -2.091125 -1.996091
H -2.645949 0.335868 -2.077714
H 2.577320 -0.105130 2.114597
H 4.278097 0.389817 2.171447
H 3.826188 -1.147120 1.383800
H 5.284001 2.482519 0.491734
H 6.097604 1.005514 1.014338
H 6.502546 1.726696 -0.550120
H -1.084395 -3.085163 2.730743
H -3.189233 2.691716 2.264696
H -0.028021 -4.447403 -1.215771
H -4.803136 1.424474 -1.521806
H -0.615929 -4.949337 1.150367
H -5.082889 2.606247 0.652073


%chk=000203413-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203413

0 1
O -0.209650 0.282110 -2.102712
N 3.363109 0.713183 0.277719
C 0.884134 0.965821 -0.082264
C -0.391440 0.235253 -0.632608
C 2.187746 0.226352 -0.495756
C -0.449344 -1.242646 -0.154343
C -1.718960 0.930343 -0.228477
C 0.970688 2.439185 -0.541304
C 4.627004 0.634731 -0.499649
C -0.850157 -1.559672 1.169325
C -1.841235 1.706893 0.951807
C -0.090310 -2.302662 -1.024645
C -2.884736 0.731655 -1.012596
C 3.463382 0.055191 1.597830
C 5.800942 1.373569 0.170079
C -0.886810 -2.899872 1.612381
C -3.077550 2.279604 1.325259
C -0.140091 -3.646090 -0.587266
C -4.122398 1.303630 -0.647606
C -0.536220 -3.951597 0.734137
C -4.225487 2.084553 0.526121
H 0.818715 0.928153 1.024354
H 2.062240 -0.875150 -0.384026
H 2.362141 0.422542 -1.568792
H 1.944096 2.846308 -0.215787
H 0.906862 2.492449 -1.642046
H 0.166453 3.068362 -0.124250
H -1.007201 -0.102884 -2.545547
H 4.926230 -0.429829 -0.694042
H 4.432376 1.097131 -1.485658
H -1.154853 -0.759882 1.853143
H -0.967526 1.879103 1.588382
H 0.245553 -2.067266 -2.040040
H -2.852260 0.111847 -1.918380
H 2.493651 0.115574 2.121700
H 4.212816 0.562821 2.228446
H 3.741763 -1.027454 1.522437
H 5.513809 2.415267 0.400007
H 6.121059 0.886347 1.108208
H 6.673652 1.391868 -0.508467
H -1.200036 -3.123840 2.638590
H -3.140909 2.880734 2.239438
H 0.139123 -4.451706 -1.276227
H -5.005296 1.134582 -1.274390
H -0.573141 -4.992413 1.074905
H -5.184431 2.530200 0.812608


