%chk=000259421.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259421

0 1
S 1.276014 -0.331270 -0.771974
N -0.298688 -2.684878 1.092803
C -1.012844 -0.398933 0.521493
C -2.078693 0.492907 0.154817
C -3.393178 -0.014824 -0.023993
C -1.284529 -1.761979 0.670795
C 0.359932 0.131401 0.745876
C -3.637426 -1.413407 0.157245
C -1.868205 1.897412 -0.041417
C -2.620747 -2.263582 0.488925
C -4.455735 0.870927 -0.383973
C -2.903921 2.727618 -0.389315
C -4.219613 2.211188 -0.562495
C 2.980690 -0.110985 -0.392267
C 3.874508 -0.759819 -1.253484
C 3.439206 0.676995 0.663288
C 5.248132 -0.613008 -1.046264
C 4.818559 0.811586 0.864999
C 5.722089 0.169536 0.013981
H 0.375354 1.232828 0.875552
H 0.835129 -0.300171 1.648183
H -4.652969 -1.787719 0.021777
H -0.860503 2.297020 0.084299
H -2.807629 -3.326331 0.630431
H -5.455878 0.459388 -0.514066
H -2.735892 3.793328 -0.540208
H -5.021780 2.892205 -0.837049
H 0.662379 -2.457961 0.863842
H -0.499564 -3.657478 0.902616
H 3.511202 -1.372173 -2.078989
H 2.751043 1.194596 1.327348
H 5.952442 -1.110672 -1.711448
H 5.185810 1.423052 1.687969
H 6.793005 0.278201 0.173002


%chk=000259421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259421

0 1
S 1.400627 -0.463340 -1.048746
N -0.324801 -2.711225 0.796937
C -1.062784 -0.416738 0.368510
C -2.138628 0.501152 0.074604
C -3.511956 0.031537 0.122777
C -1.354063 -1.788227 0.595973
C 0.361133 0.040893 0.502452
C -3.764258 -1.346055 0.432102
C -1.921113 1.880830 -0.265589
C -2.720369 -2.236001 0.647209
C -4.587117 0.939379 -0.139675
C -2.990670 2.744081 -0.522346
C -4.339764 2.277769 -0.453805
C 3.128622 -0.171587 -0.483842
C 4.161506 -0.702942 -1.299195
C 3.461548 0.561106 0.681208
C 5.513553 -0.498974 -0.949310
C 4.819364 0.752330 1.028179
C 5.850605 0.227028 0.218142
H 0.447461 1.130667 0.613115
H 0.853290 -0.455170 1.358101
H -4.802335 -1.696573 0.477359
H -0.900182 2.265747 -0.355535
H -2.925271 -3.294061 0.852026
H -5.615909 0.561524 -0.093586
H -2.793119 3.788788 -0.788161
H -5.167857 2.965450 -0.655759
H 0.599602 -2.514171 0.408072
H -0.560540 -3.686107 0.968541
H 3.908632 -1.272659 -2.200644
H 2.683915 0.992246 1.318646
H 6.302190 -0.912261 -1.588056
H 5.066024 1.319864 1.932696
H 6.900364 0.380700 0.489901


