%chk=000180468.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180468

0 1
N -4.206004 0.113827 -0.467933
C -2.083263 1.282320 0.009988
C -1.463244 -0.048440 0.335011
C -3.599544 1.268715 0.270329
C 0.009710 -0.052203 0.641747
C -3.666865 -1.200929 0.021941
C -2.196513 -1.169988 0.326593
C 0.843377 0.051378 -0.647484
C -5.694024 0.136769 -0.338959
C 2.314271 0.004608 -0.335844
C 3.018298 1.188717 -0.066929
C 2.991554 -1.224314 -0.303677
C 4.383602 1.141987 0.226576
C 4.356905 -1.265504 -0.009687
C 5.056232 -0.083793 0.255603
H -1.613160 2.100478 0.586034
H -1.894684 1.505820 -1.063265
H -3.795160 1.238644 1.363312
H -4.054544 2.204081 -0.119343
H 0.295358 -0.971361 1.193872
H 0.264825 0.784211 1.323809
H -3.852581 -1.930455 -0.802786
H -4.206603 -1.581583 0.919799
H -1.766126 -2.145170 0.542695
H 0.561729 -0.769086 -1.339726
H 0.588041 0.984475 -1.189348
H -6.075001 0.071091 0.690559
H -6.117128 -0.698452 -0.919973
H -6.076133 1.065697 -0.792273
H 2.500886 2.145287 -0.086765
H 2.452932 -2.147243 -0.507973
H 4.925067 2.063595 0.432895
H 4.877521 -2.221359 0.012345
H 6.118969 -0.117920 0.483160


%chk=000180468-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180468

0 1
N -4.235577 0.041720 -0.407103
C -2.094195 1.231857 -0.053748
C -1.487585 -0.096547 0.379233
C -3.618655 1.255496 0.172146
C 0.009709 -0.143263 0.629656
C -3.774227 -1.192211 0.265288
C -2.283469 -1.188591 0.534136
C 0.857791 0.161434 -0.649467
C -5.703735 0.113092 -0.488586
C 2.350590 0.077344 -0.372545
C 3.080468 1.220104 0.046276
C 3.039637 -1.158891 -0.480606
C 4.457785 1.132217 0.351366
C 4.416504 -1.252997 -0.176886
C 5.131234 -0.106547 0.241996
H -1.620514 2.063935 0.507816
H -1.885744 1.411653 -1.127540
H -3.829884 1.344806 1.270549
H -4.064137 2.139896 -0.320906
H 0.301659 -1.138218 1.016612
H 0.290436 0.598246 1.407065
H -4.033297 -2.058279 -0.378217
H -4.313844 -1.359157 1.239720
H -1.851860 -2.140781 0.872400
H 0.567082 -0.560757 -1.435949
H 0.597033 1.170482 -1.021317
H -6.204077 0.182339 0.512084
H -6.092356 -0.788371 -0.997198
H -6.003648 0.994752 -1.083033
H 2.565429 2.185981 0.127415
H 2.492672 -2.051210 -0.810891
H 5.005621 2.026883 0.669294
H 4.932236 -2.215767 -0.270347
H 6.199616 -0.176751 0.475589


