%chk=000206266.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206266

0 1
O -5.051587 1.359651 1.105141
N 3.520131 -0.012255 -0.083594
C 2.030255 0.082539 0.149583
C 1.345191 0.674408 -1.104455
C 4.114813 1.346194 -0.334098
C 4.222876 -0.656917 1.078609
C 1.446601 -1.330365 0.398259
C 5.604227 1.210276 -0.690430
C 5.717515 -0.831237 0.757701
C 6.377022 0.514959 0.436546
C -0.160733 0.839224 -0.868914
C -0.776511 -0.383081 -0.243128
C -0.048666 -1.350396 0.333046
C -2.257520 -0.447477 -0.291168
C -3.020905 0.475881 0.424040
C -2.889957 -1.440378 -1.065761
C -4.425669 0.389193 0.351748
C -4.281122 -1.501509 -1.120312
C -5.072646 -0.588247 -0.412844
C -6.498773 1.376043 1.120588
H 1.793872 0.729060 1.033518
H 1.528406 0.005447 -1.969081
H 1.793089 1.648632 -1.378825
H 3.993397 2.030063 0.533435
H 3.574996 1.809985 -1.190566
H 3.775197 -1.659417 1.250329
H 4.102056 -0.081029 2.021292
H 1.785034 -1.718094 1.379407
H 1.850453 -2.034209 -0.364353
H 6.030519 2.208074 -0.896686
H 5.704004 0.624125 -1.626287
H 5.826412 -1.513572 -0.109479
H 6.225316 -1.319528 1.608425
H 7.431357 0.363726 0.141215
H 6.397918 1.155589 1.337960
H -0.665138 1.066495 -1.830695
H -0.354541 1.714830 -0.214280
H -0.517499 -2.225426 0.782442
H -2.561079 1.247636 1.035552
H -2.285634 -2.153269 -1.620831
H -4.765830 -2.270801 -1.722004
H -6.152447 -0.650011 -0.465975
H -6.885016 0.444864 1.544673
H -6.887556 1.559020 0.114895
H -6.706729 2.226004 1.783461


%chk=000206266-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206266

0 1
O -5.179115 1.736937 0.289912
N 3.569436 0.073476 -0.143373
C 2.098836 0.038328 0.153726
C 1.290742 0.845380 -0.891794
C 4.140491 1.433367 0.078126
C 4.362299 -0.927518 0.625760
C 1.540666 -1.406410 0.162965
C 5.613106 1.518543 -0.371182
C 5.844722 -0.924357 0.195830
C 6.473385 0.474071 0.371389
C -0.197238 0.946874 -0.493995
C -0.799940 -0.411248 -0.146557
C 0.025517 -1.461683 0.141486
C -2.286783 -0.538729 -0.112598
C -3.096308 0.612314 0.055357
C -2.940587 -1.801014 -0.254718
C -4.507637 0.514237 0.106306
C -4.342486 -1.890608 -0.205395
C -5.148679 -0.740611 -0.020924
C -6.640396 1.699133 0.359385
H 1.901346 0.485719 1.166155
H 1.390680 0.335459 -1.869474
H 1.695531 1.865188 -1.015096
H 4.073236 1.714210 1.164462
H 3.548295 2.173374 -0.485412
H 3.945168 -1.932174 0.450188
H 4.301210 -0.725874 1.730184
H 1.893729 -1.958782 1.055262
H 1.948461 -1.948394 -0.718735
H 5.990877 2.542892 -0.186236
H 5.663805 1.333571 -1.461684
H 5.903248 -1.224305 -0.868674
H 6.395387 -1.680797 0.788331
H 7.514943 0.485251 -0.001976
H 6.512030 0.728973 1.451053
H -0.769400 1.407008 -1.322945
H -0.304306 1.636095 0.370819
H -0.412049 -2.432284 0.412686
H -2.654993 1.606910 0.167691
H -2.349677 -2.704868 -0.433482
H -4.826853 -2.866706 -0.324480
H -6.237930 -0.835123 0.010210
H -6.988518 1.082344 1.211269
H -7.080521 1.312034 -0.580709
H -6.948634 2.744498 0.508985


