%chk=000207204.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207204

0 1
O 6.502151 -1.869572 -1.024078
O 1.844775 3.090668 0.856356
O -4.529243 -2.834717 0.564528
N 4.182048 -0.367513 -0.313994
N 0.797161 1.102288 0.434405
N -0.274268 0.362817 0.088225
C 3.024054 0.551113 -0.545364
C 4.070957 -1.605692 -1.152757
C 5.489368 0.317462 -0.576618
C 2.062149 0.327813 0.642372
C 5.242761 -2.536751 -0.802582
C 6.626668 -0.662131 -0.244547
C 0.798774 2.535122 0.571493
C -0.515576 3.171702 0.339423
C -1.434411 0.975339 -0.128937
C -1.587250 2.411072 -0.003917
C -2.600513 0.137479 -0.508402
C -0.575070 4.648423 0.502279
C -2.946035 -0.971057 0.279043
C -3.349792 0.476789 -1.641557
C -4.062235 -1.728558 -0.097123
C -4.463709 -0.299245 -1.994484
C -4.835010 -1.400697 -1.232999
C -3.799234 -3.296442 1.749106
C -4.583786 -4.519890 2.178436
H 2.502298 0.375709 -1.509245
H 3.343326 1.618871 -0.555229
H 4.075091 -1.392149 -2.243571
H 3.106461 -2.104099 -0.917716
H 5.555690 1.208929 0.084510
H 5.591295 0.671239 -1.624883
H 2.534930 0.682879 1.588298
H 1.828857 -0.753099 0.769648
H 5.196302 -2.876856 0.246935
H 5.308458 -3.401200 -1.485721
H 7.613066 -0.278270 -0.557597
H 6.638128 -0.926872 0.827522
H -2.572031 2.846311 -0.181786
H -1.235880 4.935747 1.333601
H -0.947897 5.145056 -0.404750
H 0.419124 5.078255 0.721094
H -2.343208 -1.225206 1.144958
H -3.066734 1.327391 -2.255413
H -5.043768 -0.033853 -2.879229
H -5.695282 -2.014328 -1.488509
H -2.763859 -3.533089 1.449367
H -3.814819 -2.489975 2.501880
H -4.148361 -4.980804 3.072161
H -5.629998 -4.265524 2.400105
H -4.609621 -5.276885 1.381668


%chk=000207204-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207204

0 1
O 5.859486 -2.601734 -0.013661
O 1.954947 3.494928 0.191088
O -3.875083 -3.026165 0.058755
N 3.851372 -0.506494 0.047438
N 0.674974 1.540731 0.436547
N -0.479817 0.800711 0.365222
C 2.709546 0.327447 -0.380457
C 3.489173 -1.926515 0.285392
C 5.029557 -0.415145 -0.852651
C 1.880127 0.785032 0.845612
C 4.690716 -2.682525 0.877284
C 6.209769 -1.188437 -0.241088
C 0.815970 2.927837 0.122866
C -0.437809 3.587808 -0.267013
C -1.612050 1.433793 -0.015045
C -1.603031 2.842541 -0.332439
C -2.843621 0.597194 -0.083521
C -0.354045 5.055809 -0.589297
C -2.731388 -0.817015 0.024881
C -4.127241 1.178853 -0.248656
C -3.885363 -1.627535 -0.035795
C -5.275579 0.355053 -0.308559
C -5.168114 -1.042947 -0.205787
C -2.570859 -3.696104 0.239701
C -2.851686 -5.194176 0.315316
H 2.039299 -0.206075 -1.098739
H 3.096224 1.229454 -0.887043
H 3.172832 -2.427524 -0.664770
H 2.641793 -1.980424 0.994282
H 5.308896 0.648386 -0.970636
H 4.808850 -0.832055 -1.867363
H 2.506950 1.440607 1.469999
H 1.528511 -0.076232 1.434221
H 4.944788 -2.253391 1.870492
H 4.473450 -3.758658 0.980858
H 7.074022 -1.205495 -0.925351
H 6.501354 -0.716202 0.721613
H -2.530744 3.329795 -0.645919
H 0.051879 5.615961 0.273201
H -1.338428 5.471365 -0.861102
H 0.355603 5.229889 -1.419091
H -1.733160 -1.240285 0.157825
H -4.251796 2.263659 -0.313870
H -6.263464 0.811567 -0.433105
H -6.045204 -1.695175 -0.252165
H -1.909930 -3.450982 -0.617076
H -2.093716 -3.325676 1.170253
H -1.906894 -5.751711 0.449497
H -3.517301 -5.423378 1.164835
H -3.337465 -5.546361 -0.610575


