%chk=000187838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187838

0 1
N 1.107357 -1.286138 0.365295
C -0.924565 -0.024189 0.081635
C -0.223268 1.256223 0.166937
C 1.127570 1.253966 0.257114
C -0.316552 -1.250261 0.192828
C -2.345666 0.172956 -0.090398
C 1.841382 -0.042493 0.208360
C -1.278892 2.284302 0.080042
C -2.557161 1.633721 -0.092318
C 1.928730 2.513493 0.383923
C -1.156252 -2.426410 0.059836
C 3.186124 -0.092026 -0.076420
C -3.153865 -0.921813 -0.173090
C -2.559700 -2.236239 -0.110601
C -3.716956 2.389879 -0.220253
C 3.972430 1.154904 -0.085539
C 3.392615 2.353352 0.147740
C -1.188288 3.663485 0.128332
C 1.559532 -2.113449 1.527578
C -0.638706 -3.752712 0.050361
C -3.603522 3.801662 -0.170608
C 3.895578 -1.330595 -0.388540
C -2.371653 4.419031 0.000035
C -3.399970 -3.384621 -0.233830
C -5.054658 1.756363 -0.405363
C 5.418072 1.053099 -0.318232
C -1.470867 -4.841134 -0.081917
C -2.870959 -4.654376 -0.216540
C 5.227484 -1.355146 -0.614704
C 6.014014 -0.133311 -0.556424
H 1.527243 3.275715 -0.328330
H 1.766806 2.946254 1.401140
H -4.230192 -0.843047 -0.288951
H 3.968585 3.275271 0.176872
H -0.233926 4.165434 0.259497
H 1.609630 -3.171818 1.208646
H 2.562631 -1.812271 1.872459
H 0.874208 -2.040501 2.387993
H 0.441904 -3.896575 0.135845
H -4.502264 4.407978 -0.268809
H 3.297615 -2.239103 -0.479527
H -2.310750 5.506664 0.035817
H -4.472829 -3.235349 -0.348155
H -5.069920 1.117967 -1.302054
H -5.314133 1.121264 0.455236
H -5.862692 2.490412 -0.519591
H 5.985598 1.981979 -0.290682
H -1.068127 -5.851934 -0.091268
H -3.514626 -5.527686 -0.312138
H 5.749270 -2.276376 -0.863555
H 7.085983 -0.216599 -0.724881


%chk=000187838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187838

0 1
N 1.074580 -1.223922 0.397027
C -0.958556 -0.002256 0.066798
C -0.262290 1.262031 0.126715
C 1.137158 1.257876 0.141193
C -0.332650 -1.243365 0.167812
C -2.378592 0.194285 -0.051683
C 1.823047 -0.018758 0.148098
C -1.293205 2.304536 0.046182
C -2.588617 1.658599 -0.061007
C 1.942799 2.551411 0.112975
C -1.156446 -2.431566 0.051701
C 3.232457 -0.087325 -0.058296
C -3.200573 -0.934336 -0.088914
C -2.603172 -2.244867 -0.052499
C -3.778326 2.423918 -0.152868
C 4.041486 1.150951 0.021708
C 3.436520 2.388400 0.152366
C -1.202438 3.715987 0.050278
C 1.640017 -2.195602 1.377041
C -0.642077 -3.767508 -0.028546
C -3.652383 3.838644 -0.141966
C 3.917025 -1.315302 -0.385540
C -2.390915 4.474673 -0.043272
C -3.439939 -3.405286 -0.149655
C -5.145293 1.775433 -0.262757
C 5.494839 1.024971 -0.051945
C -1.489505 -4.873799 -0.146474
C -2.905459 -4.694997 -0.187996
C 5.298714 -1.373832 -0.517634
C 6.103607 -0.189384 -0.303184
H 1.659386 3.117548 -0.804923
H 1.609889 3.205981 0.948538
H -4.290093 -0.865570 -0.154996
H 4.048538 3.292973 0.251031
H -0.239240 4.226765 0.127246
H 2.093787 -3.088547 0.913980
H 2.425149 -1.685565 1.958626
H 0.836989 -2.522987 2.059254
H 0.437999 -3.930091 -0.028640
H -4.559495 4.450787 -0.214062
H 3.321635 -2.210621 -0.587497
H -2.338421 5.569166 -0.039499
H -4.525086 -3.258467 -0.210537
H -5.212078 1.125234 -1.155897
H -5.362006 1.142115 0.618823
H -5.942459 2.534309 -0.336858
H 6.092988 1.936270 0.069666
H -1.064862 -5.881135 -0.216659
H -3.564915 -5.565855 -0.267769
H 5.784857 -2.313238 -0.802027
H 7.195024 -0.259480 -0.372655


