%chk=000192955.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192955

0 1
O -0.014735 1.054555 -2.493271
O 0.014343 -1.054281 2.493671
O -1.409902 3.613101 1.102707
O 1.410285 -3.612898 -1.101946
N -0.181468 1.610915 1.012973
N 0.181644 -1.610826 -1.012517
N -0.801567 2.602775 -0.943850
N 0.801495 -2.602544 0.944461
C 0.342537 0.707965 -0.044330
C -0.342587 -0.707854 0.044649
C 1.856790 0.598386 0.014504
C -1.856833 -0.598302 -0.014537
C -0.143171 1.429370 -1.353975
C 0.142871 -1.429210 1.354422
C -0.873836 2.721227 0.498900
C 0.873975 -2.721081 -0.498271
C 2.606017 0.465777 -1.163839
C -2.606372 -0.465720 1.163616
C 2.515478 0.603362 1.254176
C -2.515198 -0.603255 -1.254378
C 3.997235 0.349085 -1.102077
C -3.997576 -0.349044 1.101490
C 3.906894 0.490046 1.310166
C -3.906601 -0.489954 -1.310730
C 4.651253 0.363502 0.133245
C -4.651270 -0.363444 -0.134003
H -0.181015 1.338362 1.993312
H 0.181415 -1.338280 -1.992860
H -1.213748 3.287722 -1.573335
H 1.213687 -3.287392 1.574047
H 2.115736 0.451374 -2.141534
H -2.116358 -0.451336 2.141445
H 1.954017 0.691139 2.185880
H -1.953490 -0.691008 -2.185935
H 4.571533 0.245465 -2.022984
H -4.572118 -0.245451 2.022248
H 4.411337 0.499620 2.276363
H -4.410790 -0.499514 -2.277061
H 5.736237 0.274631 0.179076
H -5.736243 -0.274585 -0.180117


%chk=000192955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192955

0 1
O -0.030462 1.085946 -2.470246
O 0.032446 -1.086553 2.468919
O -1.454566 3.582027 1.263055
O 1.453552 -3.581631 -1.266183
N -0.189103 1.571786 1.063224
N 0.188285 -1.571422 -1.064804
N -0.793780 2.616514 -0.826578
N 0.794390 -2.616700 0.824232
C 0.352800 0.729454 -0.006941
C -0.352796 -0.729390 0.006013
C 1.892972 0.619356 0.034905
C -1.892995 -0.619243 -0.034632
C -0.152922 1.476115 -1.279113
C 0.153859 -1.476441 1.277588
C -0.874594 2.688908 0.610377
C 0.874100 -2.688687 -0.612805
C 2.645208 0.360156 -1.140139
C -2.644288 -0.360087 1.141025
C 2.576841 0.750421 1.271071
C -2.577847 -0.750183 -1.270268
C 4.049260 0.224461 -1.074656
C -4.048385 -0.224326 1.076665
C 3.980131 0.612761 1.333205
C -3.981180 -0.612462 -1.331278
C 4.722910 0.345486 0.161172
C -4.723019 -0.345241 -0.158637
H -0.191267 1.284423 2.042222
H 0.189652 -1.283810 -2.043729
H -1.243867 3.308583 -1.426504
H 1.244960 -3.308926 1.423613
H 2.142148 0.286867 -2.108739
H -2.140450 -0.286852 2.109226
H 2.025434 0.965026 2.191292
H -2.027179 -0.964731 -2.190944
H 4.614076 0.024960 -1.991533
H -4.612465 -0.024855 1.994001
H 4.490823 0.717736 2.296526
H -4.492638 -0.717343 -2.294203
H 5.812047 0.238865 0.209998
H -5.812190 -0.238569 -0.206593


