%chk=000266402.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266402

0 1
O 0.187239 -0.654491 0.766593
O -6.822566 0.569854 -0.728029
O -6.690500 -0.808744 0.934238
N 0.292050 0.885611 -0.925577
N -6.194447 -0.093024 0.080261
C 1.635501 -0.468544 0.554568
C 1.713811 0.591245 -0.609730
C 2.257298 -1.786240 0.191689
C 2.504873 1.806825 -0.188816
C -0.476196 0.175617 -0.153579
C -1.943373 0.104457 -0.091862
C 1.496075 -2.818517 -0.370907
C 3.630905 -1.968546 0.415421
C 1.890232 2.951398 0.333984
C 3.903374 1.763095 -0.316469
C 2.106987 -4.028775 -0.712143
C 4.236215 -3.178783 0.069199
C 2.669408 4.043928 0.729121
C 4.675951 2.855319 0.083045
C -2.710982 0.847951 -1.004204
C -2.564101 -0.703056 0.876707
C 3.476179 -4.209553 -0.495047
C 4.060701 3.997595 0.607628
C -4.103690 0.784869 -0.949766
C -3.955296 -0.769598 0.935858
C -4.712865 -0.023887 0.020213
H 1.996485 -0.075418 1.528581
H 2.174143 0.143401 -1.532923
H 0.426583 -2.675056 -0.530075
H 4.225918 -1.172254 0.860435
H 0.804544 3.000910 0.421921
H 4.389022 0.881910 -0.732764
H 1.513215 -4.831489 -1.147591
H 5.302156 -3.321110 0.241688
H 2.186821 4.933969 1.130910
H 5.759639 2.819387 -0.017713
H -2.213967 1.473901 -1.753979
H -1.949510 -1.275082 1.580310
H 3.950991 -5.152267 -0.762498
H 4.664772 4.848788 0.916516
H -4.720858 1.357052 -1.652366
H -4.459033 -1.392848 1.683753


%chk=000266402-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266402

0 1
O 0.121617 -0.792815 0.752599
O -6.950615 0.878607 -0.608340
O -6.875634 -0.758531 0.978897
N 0.161748 0.877175 -0.875406
N -6.307923 0.062227 0.158978
C 1.595955 -0.527537 0.539312
C 1.600861 0.543545 -0.641466
C 2.324978 -1.816311 0.241364
C 2.454955 1.761762 -0.314196
C -0.558062 0.108019 -0.098287
C -2.030166 0.083458 -0.025677
C 1.872154 -2.687457 -0.782833
C 3.498259 -2.146405 0.962022
C 1.910596 2.871889 0.376827
C 3.830697 1.765004 -0.654068
C 2.582955 -3.869720 -1.077569
C 4.216976 -3.325325 0.660242
C 2.731443 3.967227 0.725516
C 4.653701 2.857829 -0.300955
C -2.780267 0.963134 -0.852753
C -2.695682 -0.804347 0.860571
C 3.760152 -4.190565 -0.359410
C 4.106051 3.962342 0.391708
C -4.183925 0.960335 -0.796718
C -4.101484 -0.815510 0.924858
C -4.824208 0.068534 0.094451
H 1.964784 -0.073633 1.475854
H 1.993009 0.071704 -1.562868
H 0.954531 -2.449880 -1.333970
H 3.849658 -1.480359 1.759735
H 0.841584 2.884120 0.616198
H 4.257954 0.914097 -1.199654
H 2.221657 -4.542333 -1.863314
H 5.124282 -3.570930 1.222914
H 2.299762 4.825778 1.252169
H 5.715550 2.851066 -0.571273
H -2.242297 1.635435 -1.527473
H -2.103797 -1.474889 1.489290
H 4.311852 -5.108542 -0.590168
H 4.741455 4.813185 0.661693
H -4.788621 1.624682 -1.418909
H -4.642791 -1.486265 1.596710


