%chk=000183403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183403

0 1
O -1.251066 -1.230138 0.355049
N 1.468248 -1.026791 -0.006048
N -2.566462 0.560021 0.901455
N -5.957748 -0.734456 -0.071359
N -0.290874 2.221944 0.606994
C 1.098415 0.308232 0.191268
C 2.268914 1.158806 0.090737
C 3.386739 0.274476 -0.179455
C 2.861493 -1.065445 -0.234177
C -0.161982 0.879114 0.453046
C -3.813123 -0.235939 0.976324
C -4.628374 -0.094164 -0.329740
C 2.109941 2.526397 0.254868
C 4.754315 0.485343 -0.376373
C 3.688657 -2.171000 -0.481350
C -1.363255 -0.020432 0.553949
C 0.808722 3.009651 0.510339
C 5.572141 -0.614711 -0.621372
C 5.043734 -1.921996 -0.672391
C -6.402353 -1.549802 -1.239023
C -6.988165 0.287668 0.277304
H 0.809495 -1.802358 0.011571
H -3.567043 -1.312457 1.148606
H -4.404109 0.102354 1.855043
H -4.701856 0.969357 -0.636028
H -4.085771 -0.609924 -1.151644
H 2.954859 3.207638 0.189586
H 5.164086 1.492792 -0.337244
H 3.284268 -3.177874 -0.520713
H -2.642610 1.569722 1.022845
H 0.631333 4.082529 0.645799
H 6.639671 -0.470968 -0.777120
H 5.719398 -2.756028 -0.866899
H -5.661903 -2.346987 -1.419597
H -6.545973 -0.987455 -2.172642
H -7.352450 -2.047856 -0.985782
H -7.914831 -0.231240 0.572875
H -7.232519 0.995256 -0.528308
H -6.647663 0.862221 1.153006


%chk=000183403-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183403

0 1
O -1.312221 -1.265627 0.441613
N 1.429813 -1.001183 0.002012
N -2.555471 0.668396 0.918330
N -5.896473 -0.802901 -0.159365
N -0.326653 2.231035 0.699678
C 1.076660 0.323444 0.223712
C 2.246845 1.157254 0.116567
C 3.357136 0.263297 -0.188491
C 2.808739 -1.070047 -0.251494
C -0.186568 0.883353 0.513443
C -3.851259 -0.007133 1.051941
C -4.562786 -0.183704 -0.315973
C 2.080832 2.545673 0.313235
C 4.740862 0.460163 -0.411423
C 3.616750 -2.192554 -0.530775
C -1.396524 0.003973 0.618904
C 0.779988 3.029113 0.600720
C 5.551582 -0.658680 -0.691104
C 4.992382 -1.968064 -0.749079
C -6.326201 -1.565984 -1.348459
C -6.931371 0.149431 0.289597
H 0.720274 -1.740919 0.038626
H -3.688548 -1.007391 1.487454
H -4.479871 0.576870 1.747437
H -4.612888 0.805960 -0.838884
H -3.932596 -0.848087 -0.933759
H 2.920187 3.245054 0.249161
H 5.177305 1.464108 -0.367864
H 3.195453 -3.201835 -0.577281
H -2.457735 1.686806 1.014932
H 0.609232 4.098835 0.759520
H 6.624247 -0.525160 -0.866419
H 5.645775 -2.819920 -0.968423
H -5.567176 -2.328947 -1.594438
H -6.487335 -0.929332 -2.255683
H -7.275405 -2.088140 -1.129391
H -7.874199 -0.392113 0.484760
H -7.141932 0.953623 -0.461963
H -6.626551 0.636833 1.232026


