%chk=000285152.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285152

0 1
N -0.112031 0.729130 1.443062
N 1.605202 0.928678 -0.375867
N 0.144757 2.619873 -0.216991
N 1.910904 1.896581 -1.317031
N 1.059533 2.865966 -1.185903
C -0.643314 -0.641676 1.172143
C -0.952150 1.591198 2.338927
C 0.445002 1.394637 0.332816
C -1.912816 -0.732406 0.358336
C -2.275656 2.082217 1.770107
C 2.398440 -0.265213 -0.216865
C -3.053425 -1.323678 0.923239
C -1.955464 -0.269421 -0.964035
C 2.705056 -0.720570 1.076179
C 2.864541 -0.937046 -1.358877
C -4.225521 -1.444657 0.172013
C -3.132116 -0.386948 -1.709518
C -4.268043 -0.974794 -1.144486
C 3.474891 -1.876947 1.216794
C 3.636956 -2.089019 -1.193555
C 3.938603 -2.561719 0.088039
H -0.782381 -1.118371 2.172589
H 0.153906 -1.239968 0.666981
H -1.123500 0.997487 3.265361
H -0.318825 2.466356 2.623526
H -2.133211 2.647253 0.834327
H -2.970746 1.265304 1.545409
H -2.775824 2.759412 2.472024
H -3.031668 -1.688976 1.948150
H -1.078579 0.190209 -1.417957
H 2.353614 -0.176189 1.955027
H 2.638724 -0.555673 -2.356827
H -5.107867 -1.904940 0.614103
H -3.161795 -0.017001 -2.734126
H -5.182632 -1.065930 -1.727608
H 3.720970 -2.241720 2.214338
H 4.007243 -2.619038 -2.071831
H 4.541022 -3.461600 0.207590


%chk=000285152-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285152

0 1
N -0.242927 0.922610 1.444905
N 1.639859 1.008439 -0.190276
N 0.514782 2.895097 0.262453
N 2.212278 2.070706 -0.995112
N 1.521115 3.163459 -0.670965
C -0.624634 -0.510270 1.329081
C -1.109572 1.802763 2.284356
C 0.596034 1.549205 0.551831
C -1.847050 -0.791643 0.453099
C -2.354098 2.386458 1.580520
C 2.309518 -0.258316 -0.182160
C -3.000835 -1.396480 1.008494
C -1.836529 -0.479111 -0.930977
C 2.671295 -0.867370 1.044604
C 2.667956 -0.851953 -1.415356
C -4.127740 -1.680116 0.202170
C -2.960922 -0.755725 -1.737747
C -4.111206 -1.357678 -1.173642
C 3.366454 -2.095765 1.030953
C 3.371067 -2.075483 -1.416270
C 3.716152 -2.704460 -0.197048
H -0.813952 -0.880183 2.354134
H 0.238387 -1.077095 0.942966
H -1.410014 1.195443 3.160030
H -0.477791 2.633313 2.644737
H -2.044667 3.009071 0.725680
H -3.038638 1.597678 1.227640
H -2.903945 3.028824 2.293699
H -3.020408 -1.645567 2.077261
H -0.951270 -0.011353 -1.378738
H 2.427933 -0.374377 1.992223
H 2.407233 -0.345831 -2.349344
H -5.014009 -2.147007 0.646313
H -2.941380 -0.504725 -2.804094
H -4.983695 -1.572521 -1.800553
H 3.646819 -2.567994 1.978564
H 3.650182 -2.536339 -2.369690
H 4.260017 -3.654901 -0.204139


