%chk=000202719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202719

0 1
O 5.330463 -1.611823 -0.342878
N 2.767546 -0.811700 0.637301
C 2.967166 -1.167989 -0.806844
C 4.027563 -0.212014 1.189812
C 1.619134 0.142746 0.796051
C 4.126320 -2.171130 -0.908117
C 5.162282 -1.238485 1.039794
C 0.326587 -0.593018 0.589262
C -0.822796 -0.006169 0.220281
C -2.076742 -0.783070 0.077381
C -0.938857 1.444863 -0.065294
C -2.851061 -0.665269 -1.088707
C -1.522583 2.298939 0.882418
C -2.497930 -1.641121 1.106319
C -0.473774 1.964350 -1.283601
C -4.027453 -1.405549 -1.224651
C -1.633781 3.665542 0.612535
C -3.677713 -2.376516 0.964843
C -0.590180 3.331520 -1.546920
C -4.443045 -2.262311 -0.199744
C -1.167918 4.183851 -0.600117
H 3.177218 -0.283574 -1.445952
H 2.030701 -1.631307 -1.185299
H 3.866461 0.012998 2.265466
H 4.312582 0.738537 0.689913
H 1.693705 1.032436 0.130118
H 1.629302 0.536841 1.841395
H 3.894356 -3.118949 -0.391083
H 4.422820 -2.364700 -1.953385
H 6.148122 -0.811332 1.292255
H 4.971066 -2.148076 1.636365
H 0.376128 -1.668746 0.788172
H -2.532819 0.006481 -1.884895
H -1.892191 1.892971 1.822609
H -1.907421 -1.729918 2.016454
H -0.026988 1.300294 -2.020837
H -4.623475 -1.313602 -2.131124
H -2.087384 4.327660 1.348424
H -4.001011 -3.040075 1.765148
H -0.231189 3.733896 -2.492762
H -5.360426 -2.836832 -0.308138
H -1.257186 5.248051 -0.807867


%chk=000202719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202719

0 1
O 5.289874 -1.335819 -0.634473
N 2.765992 -0.800701 0.698145
C 2.861657 -0.838313 -0.783086
C 4.054962 -0.356033 1.286342
C 1.614518 0.005901 1.186565
C 4.004366 -1.773824 -1.206944
C 5.186484 -1.294116 0.834061
C 0.291704 -0.637454 0.836666
C -0.836382 -0.037135 0.337962
C -2.112618 -0.815820 0.222319
C -0.866546 1.397272 -0.109660
C -3.039854 -0.537806 -0.821357
C -1.829319 2.295927 0.425595
C -2.433258 -1.854643 1.142321
C 0.034677 1.884394 -1.094708
C -4.227210 -1.288421 -0.957828
C -1.871406 3.644943 0.010694
C -3.620112 -2.605058 1.006789
C -0.011491 3.231138 -1.518036
C -4.523015 -2.328917 -0.046813
C -0.961027 4.119711 -0.962671
H 3.052557 0.182290 -1.205552
H 1.903621 -1.207504 -1.194853
H 3.975080 -0.382360 2.390309
H 4.307471 0.692168 0.983655
H 1.657499 1.063985 0.838051
H 1.697600 0.032964 2.294447
H 3.778870 -2.809219 -0.872110
H 4.149470 -1.759114 -2.299864
H 6.167297 -0.936189 1.188684
H 4.997248 -2.317510 1.224438
H 0.254407 -1.710634 1.072263
H -2.819186 0.264557 -1.533744
H -2.543465 1.931270 1.172627
H -1.760812 -2.053166 1.984377
H 0.757330 1.195674 -1.546160
H -4.921008 -1.062491 -1.775523
H -2.615062 4.323650 0.443491
H -3.848841 -3.395437 1.730825
H 0.687780 3.583791 -2.284680
H -5.447440 -2.908231 -0.148991
H -0.996812 5.164981 -1.289471


