%chk=000208583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208583

0 1
O -5.000122 -0.372522 0.770784
O 0.267147 2.940870 -0.510518
N 4.510411 -0.769774 0.193271
N 1.216799 1.080861 0.405505
C 3.575286 -0.507498 -0.949702
C 3.252030 0.992458 -1.053732
C 4.456379 -2.193911 0.635926
C 5.904067 -0.310862 -0.118184
C 2.603484 1.567415 0.215439
C 4.854988 -3.247394 -0.401973
C 6.710867 -0.160045 1.172374
C 0.122476 1.822667 -0.038901
C -1.207804 1.171802 0.157980
C -5.453128 -1.685446 0.272973
C -3.730075 0.055614 0.508739
C -2.231174 1.925807 0.767311
C -1.465524 -0.128066 -0.286888
C -3.490179 1.376003 0.954890
C -2.727652 -0.702275 -0.115852
C -5.786963 -1.549237 -1.203635
C -6.665982 -1.947549 1.152541
H 2.635603 -1.073848 -0.772611
H 3.975212 -0.865036 -1.923468
H 2.589189 1.162937 -1.925445
H 4.178824 1.565039 -1.262720
H 5.111074 -2.286225 1.532188
H 3.420690 -2.389419 0.992674
H 6.432810 -0.989949 -0.821701
H 5.836678 0.680616 -0.622406
H 3.202787 1.284464 1.112207
H 2.588098 2.682256 0.153555
H 4.834737 -4.252536 0.033102
H 5.869664 -3.077892 -0.780441
H 4.180174 -3.251509 -1.263774
H 7.657331 0.357090 0.984602
H 6.943094 -1.129240 1.627044
H 6.152670 0.421375 1.918607
H 1.112568 0.148229 0.784771
H -4.643473 -2.424892 0.454249
H -2.022784 2.951519 1.084312
H -0.682244 -0.702836 -0.782992
H -4.296133 1.933775 1.426680
H -2.916845 -1.712154 -0.462631
H -6.508705 -0.737909 -1.374682
H -6.224007 -2.469087 -1.606915
H -4.900746 -1.306083 -1.803521
H -7.395479 -1.128176 1.079567
H -7.173864 -2.875873 0.871191
H -6.381956 -2.016755 2.211007


%chk=000208583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208583

0 1
O -4.480411 -0.502635 0.398912
O 0.503507 3.525708 -0.220463
N 3.544976 -0.635489 -0.233232
N 1.727107 1.615960 0.298957
C 3.609648 0.279970 -1.411249
C 3.844216 1.770012 -1.048110
C 2.936680 -1.956271 -0.574783
C 4.842413 -0.724577 0.493599
C 3.041931 2.255791 0.192682
C 3.743476 -2.870657 -1.535060
C 4.742477 -1.470249 1.836644
C 0.538352 2.283812 0.076603
C -0.726186 1.471119 0.194466
C -4.644382 -1.903044 0.886284
C -3.204794 0.072510 0.352536
C -1.935885 2.076896 -0.241653
C -0.787401 0.156611 0.721004
C -3.157818 1.392167 -0.169227
C -2.008968 -0.546713 0.802165
C -4.227949 -2.897036 -0.212394
C -6.123627 -2.015325 1.267774
H 2.635437 0.196202 -1.929144
H 4.392628 -0.031098 -2.144578
H 3.554621 2.366754 -1.933862
H 4.919004 1.970494 -0.871223
H 2.746573 -2.501047 0.368394
H 1.944805 -1.749208 -1.023228
H 5.636562 -1.195152 -0.137622
H 5.177829 0.309848 0.690807
H 3.611961 2.032681 1.115192
H 2.879429 3.345625 0.144034
H 3.188868 -3.811225 -1.709656
H 4.729919 -3.138090 -1.114590
H 3.906489 -2.390787 -2.516667
H 5.694035 -1.376781 2.390916
H 4.542190 -2.548526 1.705062
H 3.936119 -1.040723 2.458137
H 1.784304 0.599182 0.426874
H -4.016525 -2.034812 1.791828
H -1.880559 3.099231 -0.629359
H 0.113158 -0.338890 1.103692
H -4.092190 1.854377 -0.501910
H -2.015112 -1.556863 1.221577
H -4.868059 -2.763532 -1.102193
H -4.343621 -3.935809 0.147885
H -3.177986 -2.752251 -0.519526
H -6.761275 -1.828453 0.386046
H -6.343998 -3.026927 1.653778
H -6.381668 -1.275981 2.044680


