%chk=000283085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283085

0 1
O 0.075106 -0.149670 2.073208
O -2.221846 2.709115 0.271699
N 0.024656 2.267173 0.327124
C -1.388574 0.348897 0.163953
C 0.060150 -0.090221 0.632566
C 0.983563 1.130368 0.176506
C -1.678949 -0.024044 -1.304088
C -2.476557 -0.204503 1.100158
C -1.324564 1.894450 0.249298
C 1.442375 1.023262 -1.296367
C -3.094872 0.386511 -1.729571
C -3.887375 0.193118 0.651521
C 0.543484 -1.482707 0.280295
C -4.151689 -0.224596 -0.800235
C 2.154634 1.356718 1.100396
C 2.416841 2.149833 -1.654478
C 3.658490 2.123013 -0.751018
C 3.335504 1.819550 0.680728
C 1.917871 -1.757669 0.191429
C -0.364019 -2.545259 0.148137
C 2.367669 -3.049973 -0.092715
C 0.084724 -3.837041 -0.136839
C 1.452712 -4.091937 -0.268328
H -1.556819 -1.114926 -1.447824
H -0.930270 0.453110 -1.975009
H -2.301328 0.135996 2.138946
H -2.386375 -1.313558 1.132722
H 0.350261 3.223303 0.316516
H 0.559841 1.047997 -1.974079
H 1.925732 0.043755 -1.475971
H -3.276899 0.077145 -2.774534
H -3.186950 1.493621 -1.710537
H -4.005735 1.296195 0.745385
H -4.637166 -0.258509 1.325327
H -5.161158 0.105662 -1.109215
H -4.147289 -1.326793 -0.888559
H 1.969390 1.115654 2.149413
H 1.910199 3.130752 -1.567521
H 2.719663 2.061081 -2.715177
H -0.219968 0.701537 2.468433
H 4.194102 3.091645 -0.822627
H 4.375957 1.357648 -1.119287
H 4.158508 1.981607 1.379518
H 2.650738 -0.966914 0.361045
H -1.436859 -2.368174 0.289972
H 3.436094 -3.245751 -0.166624
H -0.633880 -4.647615 -0.246151
H 1.803580 -5.097256 -0.492942


%chk=000283085-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283085

0 1
O 0.088893 -0.126322 2.093862
O -2.233129 2.759255 0.345100
N 0.050100 2.238218 0.281929
C -1.418983 0.365553 0.155738
C 0.050627 -0.099737 0.600718
C 1.013512 1.110806 0.118622
C -1.795966 0.031074 -1.333873
C -2.530341 -0.164843 1.124451
C -1.295670 1.912763 0.270626
C 1.522368 1.025376 -1.353269
C -3.245948 0.423874 -1.708399
C -3.975723 0.185859 0.695906
C 0.544654 -1.507275 0.239817
C -4.269298 -0.235048 -0.759742
C 2.197628 1.349478 1.055264
C 2.492755 2.184744 -1.682687
C 3.756108 2.121461 -0.798089
C 3.408209 1.813432 0.644560
C 1.935024 -1.790312 0.313790
C -0.330298 -2.590502 -0.030727
C 2.435323 -3.090103 0.091340
C 0.164491 -3.894163 -0.255609
C 1.551407 -4.152399 -0.203389
H -1.670364 -1.051908 -1.508124
H -1.102390 0.536199 -2.027453
H -2.361796 0.230157 2.142478
H -2.428907 -1.262300 1.213524
H 0.360802 3.210810 0.325436
H 0.671933 1.052269 -2.052938
H 2.039309 0.060606 -1.505988
H -3.432149 0.118461 -2.756865
H -3.365311 1.522781 -1.659477
H -4.125543 1.276073 0.791146
H -4.678290 -0.311701 1.393165
H -5.298394 0.059398 -1.041643
H -4.211401 -1.340626 -0.856989
H 2.021823 1.131136 2.114022
H 1.978079 3.154626 -1.528866
H 2.771796 2.143814 -2.752097
H -0.283088 0.732763 2.430575
H 4.323130 3.071315 -0.856927
H 4.445726 1.336370 -1.176825
H 4.199519 1.957629 1.394054
H 2.633554 -0.989501 0.574986
H -1.411373 -2.440172 -0.048152
H 3.513493 -3.274388 0.158968
H -0.538405 -4.709253 -0.461649
H 1.935210 -5.164144 -0.375700


