%chk=000207845.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207845

0 1
O 1.469739 -0.056222 2.149587
N -2.720361 0.627124 -0.036043
C 1.691644 0.988656 -0.054081
C 0.979135 -0.112600 0.785204
C 1.436269 2.385017 0.545679
C 3.207206 0.710689 -0.137929
C -0.531135 0.119023 0.991535
C 2.171556 3.479248 -0.237356
C 3.938755 1.807477 -0.921470
C 3.676957 3.194578 -0.320167
C -1.343199 0.092893 -0.309673
C 1.230973 -1.520137 0.247036
C -3.551955 -0.382953 0.699558
C -3.384004 1.029447 -1.321973
C -4.932730 0.210976 1.023848
C -4.762098 1.645909 -1.027681
C -5.651226 0.665988 -0.252332
C 1.224530 -1.790285 -1.128546
C 1.434872 -2.571281 1.152795
C 1.430204 -3.093502 -1.590789
C 1.642326 -3.872633 0.689406
C 1.641289 -4.136651 -0.684009
H 1.267905 0.967655 -1.087430
H 1.752260 2.396080 1.607682
H 0.348939 2.599381 0.554602
H 3.391124 -0.271489 -0.614722
H 3.627027 0.637709 0.886038
H -0.907030 -0.643011 1.704966
H -0.685013 1.087825 1.515594
H 1.998855 4.460546 0.243400
H 1.748845 3.560647 -1.256984
H 3.614298 1.791229 -1.979760
H 5.024919 1.598530 -0.931727
H 4.177386 3.971475 -0.926916
H 4.125794 3.257065 0.689631
H -1.349850 -0.933194 -0.737618
H -0.856743 0.752219 -1.062538
H -3.670604 -1.333056 0.135684
H -3.024668 -0.631444 1.646686
H -2.738676 1.789561 -1.813074
H -3.493660 0.182586 -2.032724
H 2.447454 0.028732 2.158424
H -4.807492 1.074545 1.707845
H -5.540239 -0.534456 1.567253
H -5.246274 1.944525 -1.974388
H -4.627995 2.573392 -0.435018
H -5.897733 -0.208008 -0.883862
H -6.614731 1.144333 0.001980
H 1.063132 -0.986388 -1.845211
H 1.425055 -2.361171 2.225283
H 1.425910 -3.295594 -2.660201
H 1.802074 -4.682048 1.399549
H 1.802387 -5.150040 -1.045340


%chk=000207845-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207845

0 1
O 1.542301 -0.000767 2.241719
N -2.740294 0.647221 0.004064
C 1.773276 1.020855 -0.019997
C 1.026772 -0.058110 0.841973
C 1.495714 2.469357 0.461171
C 3.306996 0.770389 -0.066879
C -0.487808 0.240016 1.039121
C 2.232807 3.517183 -0.408196
C 4.030639 1.803637 -0.962455
C 3.753013 3.246498 -0.482572
C -1.308773 0.347210 -0.262006
C 1.203073 -1.497552 0.299788
C -3.484015 -0.522054 0.541843
C -3.424998 1.200411 -1.192957
C -4.920248 -0.129593 0.944159
C -4.859126 1.654872 -0.851693
C -5.676917 0.486806 -0.253979
C 1.345990 -1.792921 -1.081479
C 1.156375 -2.583836 1.213740
C 1.449509 -3.127699 -1.533686
C 1.258240 -3.919095 0.765201
C 1.407362 -4.198811 -0.612650
H 1.395107 0.942547 -1.062354
H 1.815458 2.558504 1.518352
H 0.411055 2.684234 0.439400
H 3.521917 -0.255101 -0.421369
H 3.724368 0.857405 0.959759
H -0.885219 -0.568498 1.679362
H -0.595593 1.177190 1.611679
H 2.044226 4.532120 -0.006984
H 1.812549 3.499235 -1.436247
H 3.678174 1.691153 -2.009284
H 5.119301 1.600898 -0.968306
H 4.240846 3.977787 -1.156150
H 4.200137 3.387549 0.523400
H -1.190591 -0.587631 -0.866250
H -0.912593 1.179691 -0.875474
H -3.527272 -1.348332 -0.218933
H -2.945519 -0.916936 1.420996
H -2.834763 2.059604 -1.564255
H -3.469678 0.442664 -2.022140
H 2.493129 -0.283763 2.227673
H -4.868163 0.607019 1.768926
H -5.452608 -1.023280 1.323634
H -5.347928 2.049615 -1.763557
H -4.801200 2.479923 -0.115539
H -5.830465 -0.290528 -1.031581
H -6.680525 0.834765 0.056505
H 1.380245 -0.982801 -1.818137
H 1.036904 -2.366136 2.280521
H 1.562695 -3.329484 -2.605110
H 1.219594 -4.740579 1.490037
H 1.487930 -5.233954 -0.963101


