%chk=000224417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224417

0 1
O -4.238776 -2.766537 -0.528482
O -3.051490 -2.232904 1.292802
N -3.858344 0.474843 0.400592
C 3.042557 -0.215352 0.040944
C 3.378102 1.084073 -0.719639
C 4.046576 -0.426359 1.194423
C 1.602464 -0.187133 0.592022
C 4.819961 1.061071 -1.245034
C 5.490035 -0.450085 0.673283
C 5.823641 0.829388 -0.106694
C 0.551998 -0.311626 -0.519325
C -0.870292 -0.303910 0.056414
C -1.920479 -0.420088 -1.053678
C -3.366385 -0.566997 -0.534977
C -3.496894 -1.885799 0.226962
C -4.096303 1.793319 -0.266419
C -4.401648 2.849656 0.793135
H 3.139172 -1.074071 -0.667153
H 2.673615 1.222534 -1.559984
H 3.236373 1.956048 -0.054026
H 3.933056 0.378673 1.944417
H 3.824091 -1.371705 1.722260
H 1.436811 0.741837 1.169365
H 1.468816 -1.014092 1.317376
H 4.928988 0.265844 -2.007055
H 5.047447 2.012515 -1.760218
H 6.192239 -0.569843 1.519035
H 5.639229 -1.333712 0.023597
H 5.816389 1.697512 0.579787
H 6.849562 0.767477 -0.513600
H 0.672239 0.515494 -1.245671
H 0.722859 -1.244189 -1.091811
H -0.988824 -1.137438 0.782278
H -1.032374 0.622509 0.640121
H -1.683450 -1.283958 -1.708142
H -1.867551 0.469450 -1.712528
H -4.063918 -0.602787 -1.421196
H -3.211440 0.580375 1.192680
H -4.971729 1.671131 -0.944741
H -3.240307 2.122219 -0.895958
H -4.723359 3.788847 0.328969
H -3.532048 3.071708 1.421645
H -5.210699 2.519955 1.461112
H -4.371410 -3.643990 -0.082089


%chk=000224417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224417

0 1
O -3.762579 -2.982489 -0.552536
O -3.677489 -1.979909 1.538913
N -3.929549 0.535906 0.349334
C 3.036224 -0.212044 0.010239
C 3.381192 1.086488 -0.766419
C 4.057258 -0.429323 1.158145
C 1.583662 -0.214069 0.551748
C 4.842265 1.090833 -1.278254
C 5.518553 -0.433845 0.650482
C 5.847618 0.863981 -0.124163
C 0.488378 -0.287757 -0.537025
C -0.937105 -0.402834 0.049948
C -2.018221 -0.510987 -1.045370
C -3.495159 -0.579410 -0.499389
C -3.665009 -1.869838 0.292743
C -3.783353 1.898472 -0.182846
C -4.451810 2.916881 0.757990
H 3.138827 -1.066766 -0.697044
H 2.687272 1.219693 -1.619032
H 3.227593 1.954641 -0.089510
H 3.933206 0.382619 1.906763
H 3.833147 -1.380498 1.681776
H 1.426162 0.692788 1.173949
H 1.459941 -1.082332 1.233494
H 4.966328 0.284023 -2.030779
H 5.060595 2.045707 -1.795644
H 6.217065 -0.560156 1.500821
H 5.669470 -1.305645 -0.020138
H 5.801293 1.725848 0.574077
H 6.882100 0.825307 -0.518044
H 0.538284 0.606454 -1.190928
H 0.686081 -1.163780 -1.190303
H -0.985005 -1.285511 0.719587
H -1.142634 0.480392 0.689324
H -1.839539 -1.404886 -1.674089
H -1.954271 0.368192 -1.717017
H -4.158820 -0.644668 -1.384823
H -3.656683 0.421754 1.333013
H -4.275871 1.935224 -1.175969
H -2.718722 2.200704 -0.348817
H -4.358234 3.942666 0.357842
H -3.979354 2.900875 1.758990
H -5.522253 2.678686 0.882847
H -3.832356 -3.807483 0.000912


