%chk=000206895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206895

0 1
O -3.976044 1.144229 0.438798
N -1.087023 1.624020 -0.842256
N 1.647179 -1.473461 0.345841
N -2.017063 1.252954 -1.888597
C -0.243301 0.507836 -0.410900
C 1.096317 0.872166 -0.123240
C -0.640975 -0.843993 -0.311027
C 2.011747 -0.164345 0.271790
C 0.364141 -1.812729 0.056403
C -1.807217 2.281274 0.300726
C 1.603896 2.219492 -0.218651
C -1.981278 -1.334881 -0.529095
C 3.381147 0.176301 0.597892
C 0.015546 -3.217998 0.139633
C -2.756802 1.410262 1.136043
C 2.901058 2.504706 0.089133
C -2.277349 -2.660946 -0.431692
C 3.802663 1.467577 0.511806
C -1.259749 -3.622541 -0.101798
H -2.379695 3.143189 -0.115072
H -1.016438 2.710988 0.958522
H 0.924129 3.003720 -0.558323
H -2.774991 -0.614955 -0.764322
H 4.040536 -0.636948 0.906748
H 0.813060 -3.915899 0.402499
H -3.102646 1.950485 2.039388
H -2.294121 0.453679 1.441669
H 3.286022 3.520814 0.017321
H -3.291779 -3.023482 -0.594838
H 4.828854 1.743857 0.754452
H -1.541496 -4.674050 -0.045993
H -2.334244 2.134692 -2.316674
H -1.488172 0.764350 -2.624081
H -3.778211 0.688933 -0.422007


%chk=000206895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206895

0 1
O -4.020260 2.764204 -0.356667
N -1.446180 1.122222 -0.314809
N 1.898451 -1.596025 0.042322
N -2.167602 1.091052 -1.568563
C -0.322589 0.259841 -0.144786
C 1.016806 0.743834 0.027451
C -0.541503 -1.158700 -0.172448
C 2.092451 -0.243494 0.146387
C 0.614362 -2.045628 -0.122629
C -1.750619 2.295181 0.534740
C 1.375965 2.139158 0.029355
C -1.854788 -1.746955 -0.198816
C 3.444916 0.214127 0.334578
C 0.407835 -3.467577 -0.217240
C -3.261611 2.393946 0.837861
C 2.698340 2.542056 0.193615
C -2.019907 -3.128116 -0.265389
C 3.743569 1.571568 0.365417
C -0.875699 -3.997383 -0.303622
H -1.448735 3.249472 0.049558
H -1.175946 2.181569 1.471474
H 0.601307 2.896120 -0.112505
H -2.729765 -1.094209 -0.092922
H 4.216458 -0.554716 0.438861
H 1.299340 -4.101898 -0.200960
H -3.437341 3.192306 1.581881
H -3.614332 1.428733 1.264451
H 2.948110 3.608682 0.186728
H -3.026399 -3.560632 -0.263945
H 4.776703 1.907464 0.505694
H -1.022301 -5.080961 -0.369172
H -1.554987 1.339774 -2.364107
H -2.608638 0.173793 -1.728593
H -3.587712 2.240489 -1.103104


