%chk=000088580.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000088580

0 1
N -2.772668 0.079642 0.118460
N -2.337594 2.351370 0.375402
N -2.205344 -3.544992 -0.657500
C -0.543911 0.815363 1.146613
C -1.861167 1.141763 0.514495
C 0.556110 0.631892 0.091007
C 1.912158 0.341597 0.744581
C -3.970307 0.770779 -0.479625
C 3.008216 0.143291 -0.311186
C -3.677855 2.283530 -0.264049
C -2.253031 -1.092173 -0.629257
C 4.368247 -0.139210 0.340724
C -2.748945 -2.370592 0.083332
C 5.466016 -0.338983 -0.713791
C 6.822462 -0.619413 -0.070775
H -0.264259 1.636323 1.845808
H -0.639852 -0.096079 1.774047
H 0.277228 -0.200880 -0.593513
H 0.623227 1.541325 -0.539243
H 1.839530 -0.559270 1.384450
H 2.189336 1.172582 1.422517
H -4.126516 0.521479 -1.543833
H -4.864886 0.440690 0.083385
H 2.734521 -0.690480 -0.986476
H 3.078814 1.042068 -0.954111
H -4.422935 2.757746 0.405290
H -3.666758 2.860855 -1.208397
H -2.577769 -1.088956 -1.691454
H -1.133662 -1.093769 -0.653576
H 4.299799 -1.037032 0.984625
H 4.644417 0.693731 1.015557
H -3.856414 -2.361185 0.160939
H -2.362440 -2.383516 1.126567
H 5.192515 -1.174070 -1.388105
H 5.536720 0.559154 -1.358169
H 6.797680 -1.525695 0.544902
H 7.599257 -0.760136 -0.830578
H 7.141331 0.206439 0.575276
H -2.257515 -4.382122 -0.086038
H -2.744958 -3.722968 -1.498406


%chk=000088580-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088580

0 1
N -2.705858 0.065857 0.000702
N -2.275488 2.293912 0.469297
N -2.921914 -3.694151 -0.376873
C -0.489950 0.690991 1.112327
C -1.834043 1.049630 0.523500
C 0.642733 0.604256 0.052192
C 2.016053 0.292401 0.686847
C -3.829442 0.767249 -0.678054
C 3.161971 0.221690 -0.347473
C -3.635830 2.237425 -0.169911
C -2.335250 -1.296615 -0.388546
C 4.540063 -0.071942 0.287604
C -3.364999 -2.358836 0.065240
C 5.688617 -0.138488 -0.744766
C 7.062809 -0.423242 -0.100673
H -0.237030 1.482417 1.838978
H -0.555257 -0.263226 1.670898
H 0.402695 -0.171709 -0.703307
H 0.690373 1.569156 -0.488920
H 1.959011 -0.669978 1.237861
H 2.252601 1.070377 1.442510
H -3.721096 0.680672 -1.782595
H -4.809073 0.343779 -0.394401
H 2.930786 -0.561922 -1.099440
H 3.212148 1.180980 -0.903817
H -4.395581 2.501586 0.590730
H -3.704253 2.981263 -0.982724
H -2.213457 -1.365118 -1.496988
H -1.363365 -1.560618 0.058671
H 4.492069 -1.031781 0.843727
H 4.771145 0.711106 1.040098
H -4.378278 -2.070377 -0.304534
H -3.411555 -2.349152 1.169195
H 5.460008 -0.923810 -1.494200
H 5.731592 0.819397 -1.302571
H 7.055543 -1.390070 0.437493
H 7.866327 -0.464703 -0.859091
H 7.328008 0.364153 0.630137
H -3.338878 -4.477432 0.132005
H -2.945156 -3.835031 -1.391231


