%chk=000287125.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287125

0 1
O 0.042722 -1.457443 1.327149
N -0.120047 -0.577601 0.456335
C 1.150568 0.077364 -0.077568
C 2.141052 -0.962937 -0.566384
C 1.767009 0.968563 0.985056
C -1.318413 -0.201735 0.002613
C -2.574361 -0.808424 0.491599
C -1.451940 0.856413 -1.026970
C 2.549559 -2.034588 0.238005
C 2.205153 2.248365 0.610142
C 2.674142 -0.818237 -1.857566
C 1.922893 0.538825 2.309481
C 3.483373 -2.955552 -0.245535
C 2.797626 3.087598 1.557039
C 3.610490 -1.738887 -2.333764
C 2.511972 1.384597 3.253090
C -2.618441 -2.139628 0.938970
C -1.336256 2.209700 -0.669812
C -3.755365 -0.041266 0.496163
C -1.724789 0.498974 -2.355937
C 4.016919 -2.808819 -1.529084
C 2.951583 2.658141 2.879416
C -3.824988 -2.695372 1.372743
C -1.487588 3.198408 -1.644588
C -4.955140 -0.602767 0.934243
C -1.873490 1.495276 -3.324650
C -4.994953 -1.931628 1.371328
C -1.754020 2.843236 -2.971536
H 0.861776 0.721298 -0.960679
H 2.119374 -2.158017 1.237740
H 2.091507 2.591268 -0.416816
H 2.364797 0.009862 -2.492725
H 1.571274 -0.456516 2.604571
H 3.793926 -3.789109 0.382867
H 3.140650 4.078264 1.263421
H 4.023822 -1.623027 -3.334136
H 2.628176 1.047072 4.282253
H -1.703092 -2.738057 0.964219
H -1.134460 2.483184 0.366121
H -3.736511 0.994889 0.160262
H -1.828772 -0.552265 -2.624864
H 4.746062 -3.525371 -1.902640
H 3.412752 3.314106 3.615467
H -3.848261 -3.727925 1.717505
H -1.401815 4.248753 -1.369011
H -5.863524 -0.003065 0.937011
H -2.087293 1.219369 -4.356575
H -5.932302 -2.366010 1.711423
H -1.872955 3.616823 -3.728392


%chk=000287125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287125

0 1
O 0.143410 -1.662061 1.256509
N -0.085106 -0.658632 0.406825
C 1.189469 0.032900 -0.103589
C 2.178984 -1.017791 -0.607298
C 1.755210 0.972682 0.966426
C -1.318142 -0.244839 0.013372
C -2.560788 -0.914533 0.443683
C -1.415333 0.941561 -0.903706
C 3.032873 -1.723087 0.274704
C 2.524556 2.081756 0.529924
C 2.241234 -1.289798 -1.996557
C 1.558416 0.775587 2.356169
C 3.933392 -2.686831 -0.227740
C 3.090859 2.978298 1.461567
C 3.142170 -2.253926 -2.501327
C 2.119180 1.679530 3.287746
C -2.600430 -2.176122 1.122389
C -1.204402 2.261431 -0.423726
C -3.810778 -0.276091 0.155511
C -1.779711 0.756958 -2.265044
C 3.991448 -2.955719 -1.615599
C 2.888346 2.780541 2.847535
C -3.834499 -2.764600 1.468244
C -1.333328 3.369633 -1.290942
C -5.035161 -0.866526 0.519218
C -1.904387 1.864473 -3.132419
C -5.057725 -2.119453 1.176477
C -1.680557 3.175115 -2.647846
H 0.880682 0.641988 -0.968432
H 2.988640 -1.516656 1.347727
H 2.682866 2.240891 -0.544064
H 1.581963 -0.745619 -2.685426
H 0.972892 -0.084326 2.698443
H 4.589130 -3.230305 0.461705
H 3.684396 3.829023 1.108156
H 3.183194 -2.454988 -3.577683
H 1.957332 1.518684 4.359699
H -1.660188 -2.668167 1.371149
H -0.937845 2.415699 0.627686
H -3.817944 0.694089 -0.350446
H -1.964171 -0.257461 -2.636564
H 4.693524 -3.702810 -2.002993
H 3.323793 3.476271 3.573586
H -3.837138 -3.734217 1.979281
H -1.165370 4.381221 -0.905546
H -5.973316 -0.348002 0.291635
H -2.179544 1.705852 -4.181034
H -6.010802 -2.580370 1.459228
H -1.780894 4.034846 -3.319612


