%chk=000182651.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182651

0 1
O 0.123580 -1.442197 -0.537944
O 0.915916 -1.176466 1.563865
O -5.533096 2.434360 -0.193466
O -6.557750 0.953553 1.003680
N -5.594442 1.351772 0.367919
C 2.692737 1.085197 0.172782
C 3.525121 -0.195322 0.224101
C 2.105885 -0.247389 -0.362484
C 2.164843 1.644931 1.469957
C 3.002665 2.144231 -0.856809
C 4.683616 -0.419241 -0.667167
C 1.053439 -0.961620 0.381919
C 5.915903 0.055555 -0.420444
C 7.060242 -0.227081 -1.343827
C 6.247765 0.879868 0.783387
C -1.030671 -2.148595 -0.015592
C -2.208184 -1.217750 0.087898
C -2.194391 0.030778 -0.552392
C -3.337000 -1.624776 0.819317
C -3.297780 0.876653 -0.462996
C -4.446823 -0.787600 0.913209
C -4.420780 0.460720 0.270147
H 3.660882 -0.662591 1.215823
H 1.998545 -0.345843 -1.454625
H 1.863069 0.857750 2.180925
H 2.922477 2.257839 1.973405
H 1.283182 2.277845 1.307708
H 3.695723 2.894328 -0.453799
H 3.476294 1.727967 -1.756189
H 2.093514 2.669686 -1.174551
H 4.476523 -1.027653 -1.546777
H 7.413088 0.694388 -1.827817
H 7.913514 -0.656190 -0.800073
H 6.801029 -0.932929 -2.143376
H 6.465988 0.233059 1.645927
H 7.124460 1.520199 0.627761
H 5.414639 1.534804 1.075774
H -0.773378 -2.611917 0.960725
H -1.196635 -2.934721 -0.780516
H -1.309419 0.331550 -1.120456
H -3.348165 -2.592274 1.321891
H -3.300998 1.855109 -0.955628
H -5.334224 -1.088285 1.481209


%chk=000182651-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182651

0 1
O 0.320253 -1.089961 -0.838838
O 0.984588 -0.674091 1.367198
O -6.590439 0.886287 -0.408515
O -5.874884 1.501289 1.667847
N -5.714274 0.892031 0.540618
C 2.604570 1.749874 0.039569
C 3.546570 0.550793 0.216722
C 2.169019 0.355896 -0.520642
C 1.922069 2.310081 1.285679
C 2.915624 2.810999 -1.016362
C 4.817708 0.374230 -0.530681
C 1.141766 -0.479057 0.132503
C 5.913422 -0.333624 -0.120675
C 7.154552 -0.411556 -0.994292
C 6.016201 -1.087005 1.193470
C -0.751716 -2.001437 -0.314799
C -2.047061 -1.248517 -0.090184
C -3.042603 -1.216532 -1.100863
C -2.275967 -0.566073 1.134919
C -4.248785 -0.516355 -0.905550
C -3.475026 0.139722 1.348881
C -4.445000 0.152883 0.321945
H 3.522456 0.130812 1.228860
H 2.201260 0.253630 -1.608632
H 1.673591 1.517403 2.010240
H 2.590945 3.039852 1.779420
H 0.985881 2.835683 1.017778
H 3.660336 3.531082 -0.627831
H 3.316053 2.382206 -1.951207
H 1.998752 3.373242 -1.272335
H 4.873317 0.869319 -1.511009
H 8.039630 -0.004849 -0.465149
H 7.395804 -1.463165 -1.248431
H 7.032078 0.149334 -1.937032
H 6.238015 -2.156783 1.008313
H 6.853866 -0.693741 1.803301
H 5.100141 -1.035383 1.802895
H -0.386176 -2.461065 0.619849
H -0.852325 -2.758324 -1.108080
H -2.869095 -1.740775 -2.047361
H -1.500533 -0.588012 1.907347
H -5.029432 -0.479490 -1.669631
H -3.674248 0.670846 2.283148


