%chk=000207991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207991

1 1
O -0.684796 -3.166608 0.084724
O 1.832602 -1.325318 -0.547145
O -0.640956 -1.291274 1.331482
N -3.820893 -0.258138 0.399496
C -3.593476 -0.735727 1.838263
C -5.145722 0.523163 0.324689
C -3.960826 -1.471910 -0.540445
C -3.636185 0.413230 2.847271
C -5.198564 1.678926 1.328373
C -4.945680 1.198562 2.758783
C -2.682780 0.631304 -0.043244
C -2.669207 -2.194905 -0.915141
C -2.139747 -3.184682 0.124018
C -0.029693 -2.137589 0.712443
C 1.466520 -2.267331 0.463419
C 3.333837 -0.035049 -2.447688
C 2.962606 0.640440 -1.143490
C 2.215946 -0.032309 -0.155306
C 2.708754 0.706705 -3.635896
C 4.857543 -0.127497 -2.588289
C 3.351980 1.953950 -0.853134
C 1.860845 0.547249 1.062203
C 2.280656 1.861355 1.327753
C 3.021310 2.559217 0.361878
C 1.955601 2.509100 2.632641
H -4.371734 -1.489884 2.091181
H -2.592270 -1.249610 1.892128
H -5.986412 -0.181413 0.525935
H -5.283591 0.910782 -0.710436
H -4.680912 -2.190220 -0.080961
H -4.441108 -1.117400 -1.487275
H -2.764558 1.087808 2.715451
H -3.510723 -0.007135 3.870484
H -6.197257 2.166044 1.260711
H -4.474724 2.475066 1.055639
H -5.794245 0.580642 3.116719
H -4.913283 2.068411 3.449494
H -1.693657 0.168132 0.185143
H -2.723112 0.849358 -1.122729
H -2.692207 1.598223 0.496202
H -2.848491 -2.741796 -1.873474
H -1.857302 -1.482352 -1.187220
H -2.474198 -2.976511 1.155089
H -2.348065 -4.242069 -0.138172
H 2.040144 -2.136932 1.402629
H 1.723669 -3.242954 -0.011651
H 2.925142 -1.081766 -2.438761
H 2.914328 0.182592 -4.576824
H 1.623035 0.789082 -3.530528
H 3.108376 1.721591 -3.741985
H 5.308132 -0.631917 -1.725659
H 5.138396 -0.693389 -3.484139
H 5.327260 0.858847 -2.670230
H 3.934943 2.511279 -1.589879
H 1.269990 0.008459 1.797984
H 3.352446 3.577173 0.561878
H 1.601688 3.541721 2.503730
H 1.192127 1.968728 3.204753
H 2.853395 2.562445 3.271216


%chk=000207991-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207991

1 1
O -0.211162 -3.247532 -0.001833
O 2.353142 -1.794869 0.028808
O -0.376786 -1.992496 1.951800
N -3.163309 0.164702 0.323041
C -3.263096 -0.606280 1.665370
C -4.469916 0.977127 0.102016
C -3.059763 -0.822690 -0.875550
C -3.608287 0.309577 2.849520
C -4.846403 1.877647 1.289363
C -4.922688 1.083072 2.611966
C -1.960922 1.106922 0.332674
C -1.744806 -1.611761 -1.032675
C -1.649082 -2.960653 -0.272405
C 0.325351 -2.612529 1.113687
C 1.852202 -2.669001 1.099239
C 2.708624 -0.372275 -2.401662
C 2.309783 0.327661 -1.099223
C 2.136397 -0.388423 0.119978
C 1.684934 -0.104929 -3.536745
C 4.138461 0.050937 -2.836841
C 2.131560 1.731490 -1.040291
C 1.804717 0.266439 1.330190
C 1.645898 1.675589 1.367164
C 1.801250 2.400364 0.159522
C 1.364347 2.382869 2.682294
H -4.063374 -1.355474 1.517710
H -2.298319 -1.117853 1.819046
H -5.261578 0.226800 -0.076108
H -4.323551 1.561139 -0.823567
H -3.929866 -1.498393 -0.788493
H -3.212485 -0.190614 -1.768304
H -2.774853 1.006325 3.059440
H -3.692856 -0.338703 3.740753
H -5.826466 2.330163 1.050318
H -4.137767 2.721162 1.386719
H -5.771207 0.371161 2.572137
H -5.122390 1.769382 3.452600
H -1.066868 0.578959 0.694386
H -1.789885 1.480319 -0.689072
H -2.166525 1.951856 1.002183
H -1.627990 -1.813579 -2.113051
H -0.877058 -0.982066 -0.771268
H -2.198711 -2.962182 0.683209
H -1.978513 -3.808442 -0.890432
H 2.242740 -2.387779 2.092152
H 2.207185 -3.672236 0.821190
H 2.724629 -1.458989 -2.208119
H 1.978905 -0.649131 -4.452459
H 0.669624 -0.442349 -3.251272
H 1.629091 0.969717 -3.791843
H 4.877930 -0.175185 -2.048650
H 4.436669 -0.489645 -3.753487
H 4.189687 1.134794 -3.050049
H 2.267558 2.316987 -1.957143
H 1.679948 -0.299138 2.258925
H 1.693170 3.491177 0.163834
H 0.851264 3.348001 2.524955
H 0.748740 1.764770 3.361039
H 2.307571 2.603988 3.217412


