%chk=000208218.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208218

0 1
O -0.228954 0.063542 -2.195201
O -0.126065 -0.819639 1.695446
N -2.208042 0.568600 -1.170853
N -3.977215 -1.252858 0.224875
C -2.925923 0.989222 0.062633
C -2.918390 -0.520970 -1.900510
C -3.197487 -0.217981 0.983071
C -3.195268 -1.718604 -0.969664
C -0.822095 0.664104 -1.307335
C -4.294142 -2.409704 1.115183
C -0.097309 1.627853 -0.406330
C 0.674883 1.158314 0.662953
C -0.145006 2.998485 -0.691486
C 1.400572 2.062656 1.449048
C 0.735682 -0.306679 1.013984
C 0.577445 3.898077 0.096826
C 1.349115 3.430376 1.166042
C 1.926912 -1.050113 0.517016
C 2.386361 -0.877196 -0.795637
C 2.572316 -1.950792 1.379366
C 3.502987 -1.593231 -1.237260
C 3.693252 -2.654522 0.935626
C 4.159065 -2.474408 -0.372492
H -3.890801 1.450630 -0.254580
H -2.352902 1.766576 0.609842
H -2.307921 -0.844423 -2.775455
H -3.873744 -0.101354 -2.288338
H -2.236266 -0.605973 1.398468
H -3.811084 0.111304 1.848400
H -3.810165 -2.468110 -1.512723
H -2.238925 -2.217215 -0.698737
H -3.417231 -2.928347 1.531856
H -4.897002 -3.141007 0.553734
H -4.916061 -2.055508 1.953035
H -0.741348 3.358005 -1.531463
H 2.005653 1.699541 2.280268
H 0.541993 4.964517 -0.124744
H 1.914040 4.132795 1.778605
H 1.857244 -0.204149 -1.483528
H 2.190426 -2.099750 2.390408
H 3.856568 -1.464504 -2.259525
H 4.200319 -3.348099 1.603849
H 5.032113 -3.027061 -0.718372


%chk=000208218-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208218

0 1
O -0.613240 0.023493 -2.339469
O 0.022580 -1.067684 0.836975
N -2.448643 0.465511 -0.961399
N -4.373615 -1.211757 0.359081
C -3.016530 0.870655 0.342401
C -3.332291 -0.420881 -1.750442
C -3.433520 -0.377058 1.151063
C -3.741089 -1.647920 -0.912196
C -1.120132 0.600628 -1.321643
C -4.895869 -2.350944 1.139756
C -0.258328 1.558418 -0.518678
C 0.877316 1.085878 0.201655
C -0.463435 2.951315 -0.655237
C 1.780077 2.019495 0.772031
C 1.035991 -0.387217 0.479102
C 0.435420 3.875153 -0.074910
C 1.560022 3.408470 0.641921
C 2.387426 -1.024158 0.368534
C 3.412530 -0.472494 -0.446513
C 2.622128 -2.248219 1.052079
C 4.654288 -1.132522 -0.567674
C 3.866388 -2.897918 0.940569
C 4.886485 -2.340616 0.130172
H -3.907821 1.503920 0.164150
H -2.270127 1.451442 0.906254
H -2.781980 -0.728270 -2.654337
H -4.238524 0.146278 -2.037607
H -2.511601 -0.939197 1.435429
H -3.945416 -0.051602 2.076319
H -4.472782 -2.250386 -1.482346
H -2.836285 -2.280458 -0.730619
H -4.099286 -3.066144 1.465694
H -5.631046 -2.910227 0.533344
H -5.410863 -1.977270 2.043174
H -1.322455 3.310767 -1.233031
H 2.641656 1.654123 1.341195
H 0.261691 4.950728 -0.189065
H 2.259003 4.118304 1.097035
H 3.224337 0.448478 -1.007589
H 1.812064 -2.669787 1.656535
H 5.435473 -0.711924 -1.210089
H 4.044941 -3.836464 1.476516
H 5.852660 -2.849537 0.038161


