%chk=000218284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218284

1 1
O 3.400129 1.423761 0.383434
O 4.581828 -0.426468 -0.176079
N -3.600865 1.416927 0.181894
N -1.602733 -2.246412 -0.401454
C -2.123038 1.280388 0.602329
C -4.393605 0.169787 0.609513
C -1.597367 -0.039829 0.188520
C -3.889705 -1.126674 -0.045244
C -2.404326 -1.146503 -0.069515
C -3.690820 1.614176 -1.314812
C -4.197420 2.624742 0.872849
C -0.227954 -0.444034 0.020749
C -0.255430 -1.834059 -0.345267
C 1.011349 0.210757 0.144120
C 0.923434 -2.568818 -0.588922
C 2.165432 -0.518423 -0.098245
C 2.123119 -1.897871 -0.461384
C 3.513331 0.104865 0.012037
C 4.641611 2.198501 0.523939
C 5.166905 2.581806 -0.840662
H -2.044930 1.392561 1.713108
H -1.526855 2.110711 0.152280
H -5.471736 0.320717 0.371097
H -4.316619 0.075089 1.720909
H -4.298972 -1.243824 -1.074870
H -4.297381 -1.997106 0.524122
H -3.242149 2.575694 -1.628336
H -3.137781 0.818510 -1.857453
H -4.735600 1.601468 -1.671734
H -4.189461 2.517265 1.974354
H -3.637366 3.550109 0.634241
H -5.246830 2.799546 0.567523
H -1.927024 -3.171676 -0.625572
H 1.066553 1.264708 0.424730
H 0.886131 -3.621230 -0.863508
H 3.075830 -2.415489 -0.636895
H 4.276134 3.057968 1.114544
H 5.362557 1.595824 1.105969
H 6.010955 3.280306 -0.761818
H 5.530801 1.700630 -1.392566
H 4.397969 3.059497 -1.459624


%chk=000218284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218284

1 1
O 3.469432 1.436194 0.381236
O 4.621511 -0.516095 -0.185197
N -3.651934 1.418713 0.163332
N -1.616292 -2.243594 -0.373693
C -2.163419 1.295255 0.592161
C -4.420308 0.154781 0.633452
C -1.617960 -0.045161 0.201823
C -3.929077 -1.138991 -0.045982
C -2.426957 -1.153650 -0.046983
C -3.751034 1.584869 -1.351223
C -4.264166 2.639564 0.842102
C -0.237328 -0.454755 0.033979
C -0.270175 -1.849281 -0.327375
C 1.009342 0.204996 0.153503
C 0.905765 -2.592501 -0.570218
C 2.186800 -0.533236 -0.091446
C 2.130317 -1.917434 -0.448974
C 3.542065 0.091095 0.016737
C 4.778264 2.158957 0.511361
C 5.246240 2.690083 -0.845062
H -2.150415 1.468285 1.686033
H -1.621204 2.129589 0.110396
H -5.489026 0.337571 0.430157
H -4.264426 0.103332 1.724623
H -4.340845 -1.226760 -1.071233
H -4.353469 -1.985402 0.528405
H -3.345194 2.571379 -1.622862
H -3.160098 0.797465 -1.838919
H -4.807980 1.519334 -1.652409
H -4.293999 2.474628 1.929960
H -3.644710 3.521709 0.617830
H -5.284519 2.795157 0.459501
H -1.944595 -3.180006 -0.606280
H 1.092676 1.258936 0.433662
H 0.874253 -3.652038 -0.842341
H 3.077308 -2.437286 -0.624494
H 4.552538 2.969621 1.222282
H 5.515291 1.462604 0.947280
H 6.163029 3.292215 -0.706787
H 5.483189 1.862056 -1.533305
H 4.479208 3.335699 -1.306730


