%chk=000116475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116475

0 1
N -0.664077 0.777785 0.544541
C 0.808169 0.915099 0.289491
C 1.426949 -0.490235 0.156014
C -1.399811 0.467581 -0.727237
C 2.919608 -0.394552 0.008876
C -2.825955 0.063208 -0.436052
C -1.202943 2.018219 1.177426
C 3.500831 -0.298627 -1.265034
C 3.742647 -0.392294 1.145959
C -3.111971 -0.851450 0.589378
C -3.870629 0.578645 -1.217277
C 4.888824 -0.205516 -1.397643
C 5.129784 -0.298933 1.007817
C -4.429978 -1.245834 0.828227
C -5.188134 0.177291 -0.976193
C 5.706281 -0.205571 -0.263064
C -5.470718 -0.734413 0.045007
H 1.047402 1.525622 -0.606631
H 1.274597 1.433988 1.156301
H 0.978123 -1.029019 -0.702984
H 1.151491 -1.098055 1.044349
H -0.887124 -0.394343 -1.219462
H -1.368394 1.306407 -1.457226
H -0.723580 2.154839 2.159777
H -2.283104 1.885572 1.362943
H -1.067315 2.936444 0.588675
H 2.871203 -0.297913 -2.151869
H 3.299459 -0.464475 2.137263
H -2.297291 -1.238869 1.203239
H -3.662149 1.290807 -2.012225
H 5.334574 -0.133342 -2.388241
H 5.763552 -0.299608 1.893068
H -4.647679 -1.953736 1.625965
H -5.995581 0.577896 -1.586167
H 6.786251 -0.134143 -0.368420
H -6.496114 -1.045074 0.231008


%chk=000116475-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116475

0 1
N -0.666977 0.879952 0.528736
C 0.798614 0.910444 0.308596
C 1.414025 -0.507476 0.145409
C -1.438040 0.594688 -0.704004
C 2.926504 -0.445365 -0.004256
C -2.864536 0.122480 -0.430779
C -1.166665 2.083386 1.228537
C 3.527740 -0.290977 -1.280478
C 3.769790 -0.491553 1.136449
C -3.142244 -0.738603 0.660813
C -3.924666 0.498595 -1.291678
C 4.930714 -0.186280 -1.415411
C 5.173249 -0.387574 1.007828
C -4.452200 -1.217269 0.882779
C -5.236534 0.016576 -1.075548
C 5.759265 -0.233438 -0.270227
C -5.504916 -0.844332 0.013306
H 1.081713 1.538069 -0.574676
H 1.262999 1.386576 1.192404
H 0.969374 -1.006952 -0.736335
H 1.127472 -1.099266 1.033943
H -0.903507 -0.201091 -1.258378
H -1.471204 1.483906 -1.385625
H -0.636316 2.202562 2.189642
H -2.242732 1.965479 1.443426
H -1.034670 3.023788 0.636406
H 2.891479 -0.261323 -2.174275
H 3.321565 -0.617705 2.130307
H -2.319182 -1.007171 1.332618
H -3.724425 1.173436 -2.134018
H 5.377400 -0.072434 -2.409937
H 5.808621 -0.431439 1.899969
H -4.653904 -1.880805 1.731880
H -6.046671 0.316701 -1.750208
H 6.847593 -0.156209 -0.372782
H -6.521530 -1.215975 0.185167


