%chk=000206715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206715

0 1
O -3.331192 -1.718589 0.682477
N -4.638652 -0.001474 -0.007567
C 2.912245 0.275358 -0.182424
C 1.651798 -0.521764 0.179039
C 4.187030 -0.506012 0.163682
C 0.375664 0.257960 -0.166455
C 5.448601 0.289901 -0.197087
C -0.877959 -0.545148 0.197186
C 6.723054 -0.491851 0.149365
C -2.158811 0.227246 -0.142924
C 7.984708 0.303545 -0.211427
C -3.384853 -0.588965 0.216993
C -5.867373 -0.762472 0.349283
C -4.824730 1.375923 -0.520145
C 9.260205 -0.477769 0.134476
C -6.503608 -1.400821 -0.897840
C -4.691237 2.419034 0.605531
C 10.519429 0.309065 -0.222566
C -7.784485 -2.145215 -0.535380
C -4.890644 3.832806 0.071746
H 2.909982 1.245733 0.350290
H 2.904700 0.523176 -1.261307
H 1.659823 -0.771370 1.257939
H 1.654553 -1.493299 -0.352568
H 4.194636 -0.754894 1.242476
H 4.189445 -1.476863 -0.368552
H 0.368203 0.505136 -1.245463
H 0.373167 1.227957 0.366836
H 5.441423 0.538039 -1.275921
H 5.446508 1.260433 0.335406
H -0.882777 -1.521661 -0.329564
H -0.876007 -0.804923 1.275519
H 6.725080 -1.462643 -0.382816
H 6.730311 -0.740174 1.228220
H -2.174019 1.196263 0.398681
H -2.175162 0.477942 -1.223056
H 7.978856 0.552495 -1.289928
H 7.984296 1.274299 0.320364
H -5.591512 -1.561323 1.081961
H -6.585216 -0.086844 0.859343
H -4.090084 1.581169 -1.329767
H -5.828853 1.456154 -0.994931
H 9.268259 -0.725835 1.213909
H 9.262748 -1.448683 -0.398541
H -6.714281 -0.630134 -1.662909
H -5.777932 -2.098737 -1.364012
H -5.427672 2.205122 1.405406
H -3.697615 2.330156 1.089498
H 10.567342 1.260955 0.318321
H 11.423880 -0.256435 0.027736
H 10.561733 0.538604 -1.293306
H -7.593366 -2.946900 0.188981
H -8.536409 -1.478581 -0.099002
H -8.233041 -2.610769 -1.420855
H -4.150569 4.089290 -0.695063
H -5.884514 3.965036 -0.372001
H -4.794805 4.573649 0.875215


%chk=000206715-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206715

0 1
O -3.417698 -1.784897 0.575822
N -4.685357 0.072930 0.002960
C 2.955871 0.236921 -0.185047
C 1.670917 -0.548790 0.160303
C 4.253918 -0.534934 0.142658
C 0.373811 0.216272 -0.186753
C 5.538390 0.257342 -0.189999
C -0.905858 -0.566827 0.179781
C 6.837192 -0.518492 0.125691
C -2.188849 0.201918 -0.193537
C 8.121492 0.277370 -0.199085
C -3.464976 -0.581742 0.159515
C -5.925349 -0.668497 0.336375
C -4.834958 1.460853 -0.481109
C 9.420511 -0.501342 0.110683
C -6.488024 -1.469625 -0.861474
C -4.963595 2.505439 0.656239
C 10.698299 0.303689 -0.211185
C -7.804561 -2.189355 -0.499941
C -5.184908 3.931374 0.108414
H 2.954721 1.201188 0.365605
H 2.947976 0.496320 -1.264821
H 1.671490 -0.795948 1.242481
H 1.677258 -1.519024 -0.378621
H 4.258130 -0.803813 1.219898
H 4.259892 -1.494211 -0.416116
H 0.369625 0.448767 -1.273209
H 0.376597 1.194297 0.340170
H 5.529962 0.533961 -1.265397
H 5.536029 1.212684 0.375810
H -0.911660 -1.549154 -0.327816
H -0.916664 -0.789517 1.263757
H 6.842307 -1.470844 -0.445031
H 6.843279 -0.800721 1.199598
H -2.196860 1.188177 0.313022
H -2.183261 0.415439 -1.283482
H 8.114957 0.563852 -1.271934
H 8.120020 1.227588 0.375362
H -5.693099 -1.365818 1.160334
H -6.679621 0.058495 0.696583
H -3.981707 1.725113 -1.129817
H -5.739616 1.506499 -1.120173
H 9.424370 -0.790944 1.181554
H 9.423165 -1.448497 -0.466709
H -6.654219 -0.788060 -1.720152
H -5.724945 -2.206395 -1.172874
H -5.804823 2.220339 1.317598
H -4.050086 2.475316 1.281353
H 10.734406 1.240481 0.376664
H 11.612104 -0.274899 0.018666
H 10.733268 0.579661 -1.282251
H -7.653293 -2.889942 0.342423
H -8.590088 -1.468235 -0.202762
H -8.188938 -2.771941 -1.356448
H -4.345793 4.246246 -0.540466
H -6.113331 3.991105 -0.490540
H -5.267517 4.665127 0.929930


