%chk=000203480.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203480

0 1
O 6.365890 0.483354 0.138500
N 0.842547 -0.482221 0.034278
N -1.966002 0.143175 -0.124927
N -3.646669 2.105858 1.069663
N -6.222715 -0.266085 -0.166469
C 0.133846 0.159024 1.192244
C 0.216103 -0.061826 -1.263423
C -1.344277 -0.273889 1.179944
C -1.258533 -0.512008 -1.273651
C 2.273361 -0.197471 0.058493
C -3.401039 -0.063888 -0.121124
C -4.210571 0.983791 0.411129
C 3.117126 -1.306137 0.217697
C 2.818995 1.097053 -0.067780
C -4.036628 -1.190170 -0.655530
C 4.504991 -1.139022 0.252347
C 4.194568 1.281061 -0.036122
C -5.617796 0.824484 0.359840
C 5.027823 0.152700 0.124864
C -5.440211 -1.253179 -0.665299
C 7.325417 -0.588575 0.299013
H 0.204246 1.267875 1.183123
H 0.616859 -0.195032 2.129076
H 0.764442 -0.564258 -2.089467
H 0.278351 1.033195 -1.442213
H -1.890358 0.223626 2.011520
H -1.419472 -1.371200 1.346061
H -1.307858 -1.622835 -1.234846
H -1.743410 -0.185299 -2.218313
H 2.683537 -2.303323 0.314665
H 2.161507 1.956968 -0.190652
H -3.457711 -2.018160 -1.058491
H 5.148399 -2.003449 0.376090
H 4.643343 2.267278 -0.131398
H -6.283894 1.596961 0.758897
H -5.962756 -2.120390 -1.081661
H -4.219922 2.939967 1.043081
H -2.690810 2.314438 0.788473
H 8.277463 -0.042140 0.273206
H 7.254530 -1.291051 -0.536192
H 7.184589 -1.084100 1.263753


%chk=000203480-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203480

0 1
O 6.547626 0.110965 -0.248407
N 0.855066 -0.139161 -0.174785
N -2.023853 0.100319 -0.154084
N -3.579142 1.524105 1.705071
N -6.297121 -0.328913 -0.058852
C 0.119033 0.074437 1.094010
C 0.129771 0.390737 -1.344609
C -1.302509 -0.499672 1.008359
C -1.298453 -0.183368 -1.411292
C 2.280404 -0.054408 -0.159931
C -3.446573 -0.068074 -0.156630
C -4.218342 0.657340 0.814568
C 3.034885 -0.715482 0.849270
C 3.006873 0.647560 -1.168299
C -4.149001 -0.868663 -1.088181
C 4.444653 -0.678687 0.863819
C 4.413833 0.672916 -1.169574
C -5.626892 0.465926 0.822047
C 5.144716 0.015342 -0.153847
C -5.557405 -0.968506 -1.010886
C 7.333522 -0.571775 0.778017
H 0.055598 1.165023 1.328177
H 0.654394 -0.413136 1.923745
H 0.663142 0.090832 -2.263925
H 0.071913 1.505853 -1.324738
H -1.858159 -0.276442 1.934817
H -1.248110 -1.605887 0.891204
H -1.229272 -1.280053 -1.604991
H -1.839793 0.285872 -2.251847
H 2.522031 -1.297498 1.622189
H 2.478610 1.195854 -1.953527
H -3.610752 -1.427665 -1.859864
H 4.979208 -1.207851 1.658660
H 4.964320 1.212067 -1.946934
H -6.243808 0.995969 1.560539
H -6.115439 -1.586355 -1.722640
H -4.141402 2.108460 2.319536
H -2.648829 1.854490 1.445933
H 8.383739 -0.370377 0.519390
H 7.151576 -1.664894 0.767984
H 7.117244 -0.172100 1.788908


