%chk=000199357.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199357

0 1
O -0.453690 -0.066879 2.039098
N 3.177796 -1.294665 0.042097
C 0.705698 -1.244874 0.255963
C 2.039172 -0.664368 0.786622
C -0.481594 -0.289400 0.609106
C 4.479323 -1.139561 0.776135
C 3.411368 -0.647761 -1.293264
C 5.212037 0.096936 0.208645
C 4.522130 0.413793 -1.130856
C 0.470842 -2.646980 0.824023
C -0.400479 1.097150 -0.024839
C -1.812896 -0.934094 0.217693
C -1.122570 2.196078 0.491964
C 0.368100 1.280503 -1.184915
C -2.113620 -1.142599 -1.136703
C -2.736752 -1.320705 1.197010
C -1.033080 3.445174 -0.150125
C -1.995416 2.081977 1.696892
C 0.444769 2.520947 -1.819350
C -3.320954 -1.742339 -1.503167
C -3.944325 -1.920463 0.827479
C -0.256799 3.610358 -1.295958
C -4.237690 -2.135313 -0.522202
H 0.759964 -1.333055 -0.858625
H 2.037188 0.445740 0.722729
H 2.140085 -0.897736 1.867965
H 5.062018 -2.065062 0.579933
H 4.336922 -1.075234 1.869004
H 2.479894 -0.212893 -1.711657
H 3.734691 -1.454314 -1.984306
H 6.286001 -0.105612 0.072544
H 5.140366 0.952103 0.900692
H 4.098070 1.431779 -1.124184
H 5.233391 0.376618 -1.970778
H 1.358427 -3.274292 0.650807
H 0.284756 -2.634074 1.903242
H -0.380484 -3.143404 0.343190
H -0.232965 -0.904318 2.504744
H 0.936542 0.443008 -1.608071
H -1.411153 -0.827542 -1.907033
H -2.516784 -1.141013 2.249802
H -1.582703 4.294067 0.253222
H -2.771997 1.315335 1.551464
H -1.407945 1.760243 2.575599
H -2.497966 3.018738 1.958865
H 1.047479 2.638092 -2.716279
H -3.549440 -1.901192 -2.555599
H -4.657593 -2.218423 1.593774
H -0.199972 4.582733 -1.781757
H -5.176962 -2.602906 -0.809535


%chk=000199357-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199357

0 1
O -0.381232 -0.060158 2.095071
N 3.227170 -1.397207 0.094849
C 0.718049 -1.186525 0.203659
C 2.088899 -0.626124 0.678403
C -0.470394 -0.235964 0.624576
C 4.510123 -1.210232 0.835615
C 3.591927 -0.972574 -1.290770
C 5.162049 0.106971 0.284331
C 4.545388 0.265427 -1.145457
C 0.534568 -2.632375 0.725683
C -0.416693 1.184959 0.004588
C -1.820519 -0.897689 0.233136
C -1.177368 2.274818 0.545088
C 0.323426 1.405291 -1.185986
C -2.149002 -1.084360 -1.134765
C -2.732228 -1.351197 1.216328
C -1.121644 3.530310 -0.116136
C -2.060858 2.170668 1.777096
C 0.357912 2.657934 -1.834003
C -3.349150 -1.726135 -1.508244
C -3.936107 -1.993795 0.845050
C -0.366322 3.737610 -1.289422
C -4.248464 -2.189012 -0.518590
H 0.722615 -1.257461 -0.901186
H 2.150587 0.463539 0.464588
H 2.145186 -0.732030 1.777468
H 5.168829 -2.072276 0.613313
H 4.333166 -1.189950 1.924161
H 2.691874 -0.762137 -1.893122
H 4.130899 -1.806878 -1.779410
H 6.263668 0.034479 0.258308
H 4.899749 0.970171 0.921254
H 3.978639 1.210178 -1.226401
H 5.316998 0.272216 -1.935365
H 1.452131 -3.196780 0.486782
H 0.409421 -2.678544 1.828847
H -0.334813 -3.133268 0.268568
H -0.225111 -0.957210 2.489265
H 0.895673 0.585282 -1.629388
H -1.474539 -0.710590 -1.913862
H -2.505215 -1.186033 2.274922
H -1.700441 4.362231 0.303298
H -2.773874 1.332328 1.691228
H -1.462391 1.978488 2.681874
H -2.636705 3.102643 1.914367
H 0.944509 2.783088 -2.750971
H -3.586195 -1.859921 -2.569942
H -4.629649 -2.336880 1.621493
H -0.352526 4.721680 -1.771247
H -5.180818 -2.686703 -0.807846


