%chk=000213650.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213650

0 1
O -3.115806 -2.395866 -0.837162
O 3.680228 2.702178 1.007085
O 8.070590 -1.678358 -0.379459
N -1.198793 0.498239 -0.905477
N 2.310230 1.054694 0.231816
N -5.255138 1.569326 0.185471
C 1.074614 1.862765 0.407131
C 0.507460 2.305257 -0.956718
C 0.017575 1.061077 1.190134
C -0.133253 1.151346 -1.739193
C -0.620327 -0.062206 0.361898
C -1.866279 -0.580732 -1.698382
C -3.059181 -1.184367 -0.941506
C 3.566792 1.567978 0.567778
C -4.088304 -0.288876 -0.433404
C -5.346790 -0.723516 0.135929
C 4.715331 0.644259 0.335378
C -4.068204 1.105458 -0.382470
C -6.066546 0.455234 0.515741
C -5.924958 -1.985883 0.356370
C -7.342112 0.394910 1.102926
C 5.861885 1.162690 -0.300536
C 4.696015 -0.683818 0.773458
C -7.182257 -2.042731 0.936007
C -7.882689 -0.865910 1.304251
C 6.964315 0.352537 -0.527288
C 5.796479 -1.518732 0.562758
C 6.918898 -0.990931 -0.090654
C 8.161863 -3.064396 0.034512
H 1.354352 2.782404 0.998162
H -0.247892 3.097525 -0.780927
H 1.304369 2.772271 -1.567181
H 0.460593 0.637050 2.111782
H -0.773384 1.762100 1.527219
H 0.648939 0.438006 -2.077005
H -0.616106 1.553433 -2.657012
H 0.114277 -0.874777 0.178567
H -1.454265 -0.517022 0.945008
H -1.182566 -1.409686 -1.991048
H -2.250689 -0.140683 -2.646331
H 2.208145 0.148109 -0.207690
H -3.277179 1.775614 -0.701465
H -5.498688 2.527659 0.349289
H -5.370056 -2.882555 0.069922
H -7.875529 1.296095 1.384422
H 5.875218 2.212443 -0.607366
H 3.821760 -1.076835 1.295696
H -7.652611 -3.007854 1.118217
H -8.868688 -0.965409 1.756274
H 7.859822 0.725490 -1.020248
H 5.771296 -2.546022 0.909049
H 9.166470 -3.335646 -0.317262
H 8.094818 -3.140737 1.123571
H 7.396058 -3.662096 -0.467636


%chk=000213650-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213650

0 1
O -3.228886 -2.457899 -1.052077
O 3.666951 2.871538 0.089259
O 8.201552 -1.681791 -0.327659
N -1.145824 0.485511 -0.833208
N 2.285168 1.040914 0.425765
N -5.237252 1.527253 0.279134
C 1.071327 1.876367 0.560568
C 0.533679 2.333717 -0.822337
C -0.031243 1.101477 1.315640
C -0.067489 1.158202 -1.612926
C -0.635997 -0.033427 0.461773
C -1.803566 -0.582894 -1.625956
C -3.075737 -1.193273 -0.994944
C 3.531186 1.608360 0.208064
C -4.104325 -0.323954 -0.420151
C -5.402380 -0.749343 0.104531
C 4.704824 0.673017 0.109471
C -4.054999 1.077779 -0.288141
C -6.091793 0.433948 0.534854
C -6.041818 -2.007544 0.242569
C -7.384604 0.404862 1.097087
C 5.912808 1.195364 -0.429676
C 4.684887 -0.679082 0.533324
C -7.334987 -2.046903 0.804082
C -7.998834 -0.858732 1.226753
C 7.053144 0.391154 -0.563269
C 5.824914 -1.502937 0.409615
C 7.012873 -0.965927 -0.148514
C 8.221205 -3.089349 0.082130
H 1.373974 2.773128 1.130816
H -0.248456 3.100116 -0.657920
H 1.353630 2.804890 -1.392058
H 0.366532 0.689704 2.262506
H -0.838534 1.812015 1.572684
H 0.744331 0.434037 -1.882587
H -0.502963 1.523838 -2.561606
H 0.121930 -0.847167 0.292632
H -1.474100 -0.502433 1.008203
H -1.122018 -1.443637 -1.831116
H -2.091495 -0.150520 -2.605920
H 2.176017 0.026437 0.411405
H -3.225772 1.735157 -0.541924
H -5.454279 2.500349 0.487312
H -5.526489 -2.913638 -0.085353
H -7.897103 1.317630 1.420462
H 5.924561 2.247343 -0.732026
H 3.791190 -1.110060 1.001334
H -7.844063 -3.010288 0.918839
H -9.003529 -0.926901 1.658480
H 7.984911 0.783254 -0.981501
H 5.780166 -2.539969 0.754629
H 9.234389 -3.442837 -0.157781
H 8.037118 -3.194017 1.168865
H 7.475368 -3.682337 -0.481738


