%chk=000207695.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207695

0 1
O -3.619701 -2.438706 0.686873
O -0.534972 -0.490584 -2.331513
O 0.207881 1.766634 0.284084
N -1.692810 -0.656833 -0.387259
N 3.698228 -2.594225 0.449044
C -1.777357 -0.868701 1.075968
C -2.973862 -0.890047 -1.103043
C -2.358565 -2.264883 1.363823
C -3.523877 -2.279706 -0.745174
C -0.506266 -0.522962 -1.109593
C 0.769963 -0.420177 -0.328524
C 1.154550 0.768382 0.328043
C 1.630462 -1.517074 -0.316719
C 2.872068 -1.436406 0.347048
C 2.388929 0.858829 0.988224
C 3.243956 -0.241392 0.995782
C 0.608750 3.110478 0.702686
C -0.583814 3.944195 0.347406
C -0.680178 5.236095 0.646655
H -2.441348 -0.082124 1.505528
H -0.783746 -0.748521 1.557926
H -2.812112 -0.796158 -2.203954
H -3.694977 -0.096713 -0.804424
H -1.670622 -3.071987 1.058913
H -2.643128 -2.388308 2.423970
H -4.573546 -2.409049 -1.063825
H -2.899609 -3.091806 -1.155914
H 1.339966 -2.434445 -0.830304
H 2.687978 1.771296 1.496302
H 4.199446 -0.175394 1.514242
H 0.810969 3.088703 1.788482
H 1.512845 3.407292 0.139622
H 4.680876 -2.399305 0.594502
H 3.579527 -3.263861 -0.301538
H -1.367566 3.393928 -0.186195
H -1.540540 5.836547 0.382704
H 0.079102 5.798587 1.169953


%chk=000207695-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207695

0 1
O -3.984456 -1.690419 0.829757
O -0.297663 -1.295087 -2.360314
O 0.177900 1.576841 0.202878
N -1.579721 -0.801206 -0.484068
N 4.139894 -2.477064 0.181878
C -1.773626 -0.538816 0.955094
C -2.837922 -0.950324 -1.247526
C -2.707034 -1.611097 1.556998
C -3.733553 -2.013663 -0.588167
C -0.362146 -0.922167 -1.141175
C 0.910482 -0.651130 -0.367655
C 1.199160 0.598663 0.252007
C 1.905301 -1.651421 -0.397720
C 3.176125 -1.463215 0.210966
C 2.462466 0.802680 0.855140
C 3.436689 -0.216625 0.842811
C 0.532663 2.946415 0.628088
C -0.639874 3.832143 0.299707
C -1.217469 4.683512 1.181906
H -2.213896 0.467705 1.089563
H -0.800754 -0.558400 1.471593
H -2.572257 -1.233380 -2.280067
H -3.367413 0.023636 -1.260067
H -2.203032 -2.602739 1.537091
H -2.975238 -1.355288 2.595673
H -4.728250 -2.044414 -1.062177
H -3.253101 -3.012977 -0.664787
H 1.682246 -2.582462 -0.931318
H 2.704292 1.754037 1.337959
H 4.409473 -0.037540 1.316600
H 0.759037 2.971882 1.713753
H 1.437846 3.268292 0.068235
H 5.063313 -2.328522 0.576347
H 3.963587 -3.344570 -0.315157
H -1.001948 3.766596 -0.734998
H -2.044942 5.337843 0.887515
H -0.879280 4.753878 2.223438


