%chk=000261616.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261616

0 1
O -4.407481 0.733197 -0.940045
O 0.887146 -0.864336 1.106951
O 1.137532 2.091127 -1.084125
O 3.299018 0.662196 -1.852955
O 2.897125 -3.781936 0.721159
N -1.863912 0.430964 0.317681
C -2.005866 1.207017 -0.957471
C -3.119760 0.543936 1.132484
C -0.682822 0.891491 1.119225
C -3.208417 0.648097 -1.736177
C -4.291353 0.002040 0.296056
C 0.576892 0.360770 0.504344
C 1.364524 0.896083 -0.460316
C 2.013623 -1.531281 0.667497
C 2.601130 0.208532 -0.979783
C 2.833154 -1.065345 -0.291614
C 2.127120 -2.823155 1.439450
H -1.081054 1.068102 -1.562719
H -2.145082 2.296648 -0.792391
H -3.338649 1.585158 1.452738
H -3.001573 -0.071624 2.049926
H -0.614905 1.996574 1.239622
H -0.771877 0.469858 2.153477
H -3.460016 1.267470 -2.615123
H -3.047506 -0.402279 -2.037890
H -4.170013 -1.072682 0.071133
H -5.267590 0.187768 0.777272
H 3.725986 -1.620812 -0.594895
H 1.128624 -3.236338 1.689294
H 2.711749 -2.677565 2.375719
H 0.390061 2.589405 -0.662109
H 2.447891 -4.024978 -0.121515


%chk=000261616-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261616

0 1
O -4.474428 0.761501 -0.980575
O 0.840543 -0.947842 1.028288
O 1.179902 2.244918 -0.863856
O 3.480366 0.896575 -1.618098
O 3.124555 -3.801667 0.587084
N -1.935400 0.435881 0.386683
C -1.997176 0.946623 -1.006715
C -3.177137 0.776458 1.132227
C -0.725109 0.892954 1.112203
C -3.249888 0.404237 -1.713889
C -4.402009 0.222430 0.387037
C 0.559057 0.346402 0.545449
C 1.415771 0.976596 -0.336308
C 2.006913 -1.593513 0.618234
C 2.679237 0.333769 -0.808447
C 2.894394 -1.006927 -0.246239
C 2.118349 -2.972339 1.240784
H -1.098476 0.616327 -1.558514
H -2.030109 2.069552 -1.024236
H -3.293930 1.883762 1.250186
H -3.123441 0.326848 2.141940
H -0.666039 2.016555 1.154454
H -0.807026 0.548225 2.159594
H -3.361849 0.850910 -2.714981
H -3.173793 -0.700549 -1.803307
H -4.346438 -0.886680 0.352031
H -5.338514 0.532346 0.878679
H 3.807936 -1.540561 -0.519514
H 1.113178 -3.444487 1.243032
H 2.455828 -2.892980 2.288741
H 0.326554 2.626386 -0.531141
H 2.861880 -3.957609 -0.355926


