%chk=000218051.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218051

0 1
O 7.185943 -1.457807 0.419706
N 4.634231 -0.344992 -0.217341
N 1.211901 1.220040 -0.171766
N -0.463041 -0.486929 -0.072612
N -1.689011 -0.889409 -0.099901
C 5.059832 -0.536974 1.208510
C 5.833155 -0.067115 -1.075584
C 3.626325 0.756661 -0.337960
C 6.047999 -1.712910 1.268499
C 6.803440 -1.253975 -0.955674
C 2.245993 0.161805 0.007840
C -0.139641 0.866953 -0.086125
C -1.179599 1.853090 -0.113455
C -0.883151 3.324881 -0.122571
C -2.488413 1.387675 -0.135982
C -2.735560 -0.006431 -0.127423
C -0.583961 3.847772 1.281687
C -4.104090 -0.560319 -0.150569
C -5.111618 0.017740 0.639949
C -4.403550 -1.666631 -0.963001
C -6.408260 -0.500703 0.604694
C -5.703048 -2.178383 -0.992494
C -6.707216 -1.595714 -0.212682
H 4.158955 -0.773089 1.814725
H 5.528220 0.369650 1.647995
H 6.355470 0.874267 -0.801768
H 5.493907 0.032081 -2.129123
H 3.855137 1.635558 0.300466
H 3.607153 1.126041 -1.388672
H 6.512192 -1.819473 2.264075
H 5.573752 -2.661723 0.959941
H 6.358324 -2.186061 -1.347444
H 7.771904 -1.053063 -1.445372
H 2.016656 -0.694602 -0.675690
H 2.229165 -0.261180 1.036120
H 1.455428 2.127789 0.223345
H -0.037864 3.544319 -0.808875
H -1.742479 3.884690 -0.551037
H -3.326312 2.084517 -0.168481
H -1.442545 3.702855 1.950595
H -0.359569 4.920724 1.265197
H 0.267615 3.337006 1.743199
H -4.882040 0.859581 1.289717
H -3.615799 -2.128655 -1.560357
H -7.187260 -0.052557 1.218898
H -5.932061 -3.036073 -1.623182
H -7.718510 -1.996425 -0.238317


%chk=000218051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218051

0 1
O 7.319307 -1.359341 0.374320
N 4.688900 -0.292319 -0.252876
N 1.177562 1.085377 -0.038734
N -0.497045 -0.549015 -0.085918
N -1.804990 -0.932519 -0.115422
C 5.051663 -0.688129 1.133903
C 5.899870 0.149566 -0.993250
C 3.589367 0.692052 -0.315136
C 6.116526 -1.796876 1.102378
C 6.949211 -0.974208 -0.997506
C 2.214252 0.039631 -0.064245
C -0.173824 0.797893 -0.050034
C -1.174837 1.834982 -0.053463
C -0.804689 3.306453 -0.006434
C -2.502676 1.400780 -0.093291
C -2.811746 0.006823 -0.114736
C -0.398171 3.784613 1.416809
C -4.201677 -0.525323 -0.149990
C -5.333185 0.306725 0.074398
C -4.420472 -1.907191 -0.411981
C -6.640936 -0.222954 0.029053
C -5.726223 -2.434660 -0.455166
C -6.845859 -1.595976 -0.237880
H 4.155291 -1.063878 1.659408
H 5.449884 0.186076 1.710051
H 6.352278 1.066574 -0.536777
H 5.616042 0.388764 -2.035690
H 3.744761 1.535562 0.412754
H 3.585042 1.138646 -1.327869
H 6.461489 -2.044860 2.119648
H 5.693152 -2.703181 0.618777
H 6.544090 -1.856173 -1.538704
H 7.886035 -0.642492 -1.474961
H 1.985958 -0.685966 -0.862510
H 2.204512 -0.530602 0.885783
H 1.473847 2.050975 0.096788
H 0.019334 3.516538 -0.719411
H -1.666591 3.908157 -0.349267
H -3.303241 2.146957 -0.127823
H -1.242337 3.668145 2.118669
H -0.106417 4.850162 1.402564
H 0.449006 3.202902 1.824525
H -5.205196 1.371117 0.301454
H -3.545499 -2.543041 -0.574053
H -7.499041 0.435078 0.207535
H -5.873328 -3.501067 -0.660721
H -7.861301 -2.006277 -0.273267


