%chk=000213673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213673

0 1
S 3.288495 -1.553098 0.587744
S 3.303207 1.404979 0.414590
N -1.569386 -0.143660 -0.119994
N 1.304649 -0.121625 -0.467246
C -0.790102 1.136956 0.066668
C 0.486149 1.074665 -0.818291
C -0.725108 -1.325364 0.260109
C 0.526617 -1.380846 -0.636575
C -2.848581 -0.150573 0.668634
C -1.618549 2.344094 -0.384631
C -3.780464 -1.244384 0.146504
C 2.501931 -0.020553 0.128747
H -0.480355 1.277876 1.135848
H 0.208870 0.999320 -1.895167
H 1.073416 2.016423 -0.702890
H -1.327215 -2.247032 0.093297
H -0.427135 -1.323084 1.331885
H 1.121016 -2.291526 -0.414108
H 0.225828 -1.457419 -1.710507
H -2.679123 -0.277035 1.760075
H -3.347129 0.837918 0.539136
H -1.998922 2.211951 -1.406717
H -2.490607 2.503363 0.262258
H -1.025465 3.265864 -0.361886
H -3.857946 -1.203075 -0.949213
H -3.431104 -2.248912 0.407690
H -4.789571 -1.126374 0.556087
H 4.456783 -1.032448 1.047451


%chk=000213673-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213673

0 1
S 3.399964 -1.669540 0.385036
S 3.484151 1.429558 0.271065
N -1.602615 -0.122223 -0.135528
N 1.295350 -0.109565 -0.354537
C -0.833792 1.143519 0.099851
C 0.494708 1.090352 -0.693765
C -0.786679 -1.294821 0.267126
C 0.523715 -1.361539 -0.537308
C -2.942906 -0.126426 0.518505
C -1.609763 2.398658 -0.346945
C -3.799699 -1.352615 0.149004
C 2.596714 -0.016114 0.056166
H -0.574191 1.241862 1.186294
H 0.264882 1.062951 -1.778085
H 1.108311 1.978531 -0.475202
H -1.355613 -2.217524 0.062959
H -0.541105 -1.277487 1.360071
H 1.116066 -2.231094 -0.213143
H 0.288940 -1.475601 -1.613770
H -2.850278 -0.056584 1.633712
H -3.477938 0.777313 0.182772
H -2.013975 2.256633 -1.365798
H -2.444111 2.642175 0.331729
H -0.934149 3.272786 -0.357927
H -3.825340 -1.483591 -0.947587
H -3.429995 -2.288238 0.604690
H -4.835486 -1.204320 0.504613
H 4.595032 -1.080654 0.745497


