%chk=000208422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208422

0 1
O 1.125615 -2.072604 -0.022985
O -3.390794 -1.284304 -0.069360
N 0.444383 0.145697 0.001711
N -1.144028 -1.690066 -0.057101
N -2.974988 1.627703 -0.014062
C 1.888338 0.601962 0.029647
C 2.589696 0.098749 1.304611
C 2.627291 0.136899 -1.238572
C 4.034478 0.614280 1.332247
C 4.071976 0.652565 -1.207976
C 4.798102 0.198197 0.066572
C -0.622834 1.069645 0.004368
C 0.205993 -1.272658 -0.027400
C -1.922541 0.620908 -0.019753
C -2.275858 -0.798836 -0.050878
C -0.330597 2.531890 0.034906
C -1.383292 -3.158723 -0.106544
C -3.802767 1.528663 -1.256519
C -3.829219 1.486652 1.206242
H 1.882716 1.729973 0.046232
H 2.588106 -1.014058 1.324824
H 2.042255 0.422149 2.207152
H 2.106600 0.487409 -2.146795
H 2.627128 -0.974819 -1.292292
H 4.550284 0.218410 2.228159
H 4.046160 1.715702 1.436660
H 4.086147 1.756628 -1.278731
H 4.614218 0.283708 -2.099799
H 5.821320 0.616277 0.087977
H 4.916071 -0.903865 0.051697
H -0.801377 2.996097 0.921281
H -0.802440 3.033153 -0.830715
H 0.737483 2.796405 0.039633
H -1.199338 -3.544249 -1.123149
H -2.433636 -3.373104 0.168115
H -0.710750 -3.684635 0.593067
H -3.150658 1.629654 -2.136764
H -4.519049 2.363903 -1.267862
H -4.365349 0.583620 -1.350293
H -4.546069 2.321126 1.230567
H -3.196213 1.557568 2.103209
H -4.393068 0.539029 1.255674


%chk=000208422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208422

0 1
O 1.133630 -2.181192 -0.061353
O -3.460490 -1.312557 -0.090402
N 0.434607 0.072839 -0.025300
N -1.149640 -1.732394 -0.083285
N -3.020976 1.546138 -0.039339
C 1.875389 0.519594 0.024750
C 2.586144 0.067332 1.325843
C 2.672448 0.115839 -1.242130
C 4.016366 0.659551 1.377978
C 4.102983 0.707264 -1.172460
C 4.832101 0.271285 0.121256
C -0.622197 1.006123 -0.022593
C 0.198011 -1.327567 -0.057360
C -1.948388 0.582226 -0.046475
C -2.276944 -0.848792 -0.074277
C -0.306502 2.483677 0.006452
C -1.391108 -3.192280 -0.114605
C -3.838350 1.566327 -1.278975
C -3.839037 1.542212 1.200116
H 1.841784 1.621996 0.043943
H 2.634336 -1.034615 1.350285
H 1.999895 0.399548 2.205000
H 2.147518 0.483743 -2.145408
H 2.722723 -0.984241 -1.306499
H 4.528406 0.305896 2.293053
H 3.961879 1.766557 1.449703
H 4.052648 1.816311 -1.205996
H 4.676631 0.387780 -2.063292
H 5.838859 0.729859 0.163547
H 4.976624 -0.827900 0.105845
H 0.247379 2.773609 0.918527
H -1.274245 3.009594 -0.007515
H 0.289355 2.798664 -0.870075
H -0.925389 -3.633586 -1.011030
H -2.480856 -3.338309 -0.129915
H -0.945890 -3.668660 0.774257
H -3.174884 1.659188 -2.156751
H -4.500341 2.451978 -1.253867
H -4.463190 0.655497 -1.397900
H -4.503930 2.425965 1.191168
H -3.176272 1.620686 2.079898
H -4.461590 0.627516 1.302182


