%chk=000200019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200019

0 1
O -1.060338 -1.415018 -1.661827
O 5.095166 0.791641 0.659993
N -4.504512 0.469974 -0.028614
N -0.458658 -2.292172 0.357833
C -4.949430 1.714865 -0.739331
C -5.659599 -0.459820 0.202821
C -6.010444 2.444683 0.101588
C -6.729166 0.238099 1.059430
C -7.208999 1.533119 0.392331
C -3.410205 -0.215055 -0.789280
C -2.502881 -0.935405 0.225341
C -1.295577 -1.526019 -0.468393
C 0.822903 -2.821488 -0.174501
C 1.952493 -1.843854 0.027932
C 2.905427 -2.046311 1.041033
C 2.048618 -0.719872 -0.803690
C 4.024108 -0.018825 0.373169
C 3.945885 -1.142794 1.223027
C 3.083126 0.204646 -0.641255
C 5.295618 1.988752 -0.156848
C 6.556680 2.601700 0.451187
C 6.940958 3.886807 -0.270875
H -5.348332 1.509211 -1.755833
H -4.060082 2.370873 -0.861983
H -5.275284 -1.352095 0.741983
H -6.112985 -0.823548 -0.744724
H -5.555594 2.776132 1.056758
H -6.336968 3.359338 -0.424908
H -7.577505 -0.448855 1.228620
H -6.306309 0.469346 2.057647
H -7.933890 2.052847 1.045319
H -7.749033 1.302081 -0.545118
H -2.801496 0.530732 -1.348883
H -3.775281 -0.937526 -1.550833
H -3.074609 -1.720412 0.760221
H -2.194004 -0.212181 1.011333
H -0.514763 -2.215067 1.367746
H 1.028510 -3.796007 0.321121
H 0.694283 -3.039643 -1.265661
H 2.833964 -2.918949 1.689920
H 1.298217 -0.565697 -1.587119
H 4.696143 -1.280105 1.997364
H 3.141444 1.067838 -1.294531
H 5.432317 1.680513 -1.206399
H 4.410737 2.637868 -0.053125
H 7.384876 1.864508 0.408456
H 6.392344 2.792358 1.531812
H 7.846979 4.324918 0.166555
H 6.151332 4.644814 -0.205401
H 7.146917 3.712956 -1.333807


%chk=000200019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200019

0 1
O -1.413290 -1.047412 -2.185419
O 5.652263 0.437003 0.676960
N -4.975283 0.398979 -0.293913
N -0.466918 -1.621435 -0.137538
C -6.117350 0.563281 -1.232063
C -5.448883 0.005500 1.057683
C -7.099810 1.638922 -0.726608
C -6.413048 1.058642 1.641045
C -7.609981 1.292710 0.691083
C -3.944812 -0.518877 -0.835311
C -2.581011 -0.350433 -0.131452
C -1.454925 -1.035505 -0.915158
C 0.737545 -2.247824 -0.718480
C 2.024894 -1.517415 -0.354791
C 3.065278 -2.171631 0.353790
C 2.214698 -0.164500 -0.727515
C 4.431161 -0.145477 0.304097
C 4.258556 -1.499488 0.682656
C 3.402296 0.526839 -0.406012
C 5.890299 1.842784 0.298957
C 7.279506 2.221190 0.818110
C 7.634484 3.684658 0.475345
H -6.673359 -0.403569 -1.367167
H -5.713188 0.850950 -2.220399
H -4.574592 -0.105690 1.724652
H -5.968473 -0.991012 1.023502
H -6.577059 2.614676 -0.704457
H -7.945733 1.726340 -1.435593
H -6.763594 0.725361 2.637147
H -5.859754 2.007799 1.778695
H -8.262004 2.098720 1.077982
H -8.227103 0.371133 0.643836
H -3.789751 -0.284633 -1.903478
H -4.265767 -1.591182 -0.781670
H -2.609091 -0.720220 0.911011
H -2.365277 0.735486 -0.089646
H -0.525930 -1.542842 0.879401
H 0.797911 -3.304138 -0.392943
H 0.566828 -2.239237 -1.810958
H 2.943036 -3.221120 0.650009
H 1.424158 0.353999 -1.283218
H 5.065514 -1.998741 1.227656
H 3.517273 1.570215 -0.713789
H 5.837767 1.945535 -0.805527
H 5.108782 2.489079 0.751881
H 8.024448 1.532400 0.378218
H 7.305472 2.066242 1.912798
H 8.638446 3.942526 0.855756
H 6.912677 4.391456 0.926360
H 7.635797 3.853854 -0.617924


