%chk=000209602.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209602

0 1
O -0.763103 -1.137064 1.180322
O 1.143943 -3.550208 -0.710086
N 3.087854 -1.354177 -0.560627
C 3.428149 0.073130 -0.852428
C 1.986963 -1.536085 0.425368
C 0.805579 -2.211787 -0.304860
C 4.168777 0.759710 0.323902
C -0.388208 -2.427971 0.644085
C -0.084603 1.538838 0.958375
C -1.387157 1.005443 0.402991
C 4.280892 0.086328 -2.127931
C -1.674913 -0.375999 0.458537
C 4.170148 2.278701 0.195831
C -2.351721 1.833571 -0.179755
C 0.548002 2.567867 0.013470
C -0.306419 2.125945 2.357190
C -2.837562 -0.925507 -0.086938
C -3.775938 -0.070801 -0.685659
C -3.529865 1.309558 -0.721190
C -5.027990 -0.641113 -1.268037
H 2.467938 0.617904 -1.051904
H 1.610893 -0.570964 0.862441
H 2.306651 -2.164148 1.281667
H 0.514105 -1.634436 -1.210169
H 3.920406 -1.866292 -0.256277
H 3.695105 0.475210 1.283782
H 5.209320 0.387759 0.383969
H -0.110191 -2.994442 1.551870
H -1.226854 -2.933777 0.139581
H 0.634387 0.668148 1.052844
H 4.478370 1.111778 -2.456567
H 5.247218 -0.408812 -1.987640
H 3.766029 -0.435419 -2.945335
H 4.727264 2.745399 1.016005
H 3.143282 2.685329 0.222516
H 4.630865 2.608088 -0.742388
H -2.178689 2.909514 -0.220537
H 0.533231 2.216323 -1.024465
H 1.599777 2.760007 0.284991
H 0.024434 3.528808 0.041910
H -0.709076 1.365665 3.038193
H 0.627884 2.499097 2.787115
H -1.020609 2.956087 2.339776
H -3.019387 -1.994994 -0.032507
H -4.256267 1.980193 -1.172544
H 1.949390 -3.522602 -1.274752
H -5.643909 -1.117726 -0.491296
H -5.654245 0.116604 -1.756105
H -4.804851 -1.409881 -2.021730


%chk=000209602-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209602

0 1
O -0.508837 -0.523215 1.519993
O 1.345892 -3.186667 -0.328515
N 3.454532 -1.599948 -0.298975
C 3.696888 -0.880363 -1.588368
C 2.324698 -1.122751 0.543309
C 1.023697 -1.805910 0.023491
C 4.301018 0.538617 -1.378345
C -0.083581 -1.866385 1.087416
C -1.129887 1.997793 2.533566
C -1.748993 1.504303 1.222928
C 4.583653 -1.765279 -2.487763
C -1.426696 0.202811 0.727637
C 4.321282 1.410827 -2.653363
C -2.670417 2.263907 0.470078
C -1.107351 3.537277 2.669857
C -1.860513 1.354996 3.748021
C -2.005303 -0.298590 -0.459926
C -2.937774 0.479269 -1.194811
C -3.261613 1.768864 -0.717154
C -3.563420 -0.076192 -2.463879
H 2.706519 -0.766499 -2.073949
H 2.200848 -0.021100 0.557517
H 2.510788 -1.456788 1.581247
H 0.652568 -1.260779 -0.871415
H 4.327318 -1.713348 0.233258
H 3.716260 1.062685 -0.596559
H 5.332803 0.428712 -0.982806
H 0.305591 -2.347441 2.000550
H -0.940745 -2.459715 0.718211
H -0.084149 1.632650 2.557944
H 4.738611 -1.304025 -3.478552
H 5.579287 -1.917764 -2.026522
H 4.117898 -2.755100 -2.635072
H 4.689226 2.428645 -2.429698
H 3.305781 1.508651 -3.081611
H 4.977704 0.984470 -3.433035
H -2.934298 3.269735 0.813363
H -0.618215 4.017852 1.802657
H -0.552904 3.826105 3.581822
H -2.128156 3.954041 2.763208
H -1.833955 0.253979 3.682691
H -1.378806 1.658790 4.696730
H -2.917998 1.678240 3.778825
H -1.744609 -1.294745 -0.833143
H -3.973868 2.390478 -1.271912
H 2.340993 -3.124186 -0.526858
H -4.179043 -0.970899 -2.250981
H -4.214928 0.670753 -2.949150
H -2.792498 -0.379961 -3.196953


