%chk=000027180.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027180

0 1
 O   -4.775500     -0.4614000     -0.4127000    
 N    2.949400      -1.564000      0.2121000    
 C    1.548600      -1.396800     -0.1736000    
 C   0.6761000     -0.9153000      0.9830000    
 C  -0.7764000     -0.7659000      0.6020000    
 C    3.505700     -0.2950000      0.6798000    
 C    3.730400      -2.081700     -0.9108000    
 C   -1.265300      0.4329000      0.1025000    
 C   -1.609200      -1.864400      0.7663000    
 C  -0.4069000       1.587300     -7.4100003E-02
 C   -2.613700      0.5360000     -0.2395000    
 C    4.939000     -0.4546000       1.142900    
 C    3.173700      -3.397300      -1.414200    
 C   -2.957500      -1.761400      0.4243000    
 C   -3.459800     -0.5612000     -7.8800000E-02
 C  -0.2522000       2.504000      0.9641000    
 C   0.2632000       1.776200      -1.281200    
 C   0.5756000       3.613700      0.7944000    
 C    1.091100       2.885900      -1.450800    
 C    1.247300       3.804700     -0.4130000    
 C   -5.583500      -1.621900     -0.2227000    
 H    1.119300      -2.355100     -0.4863000    
 H    1.463700     -0.7240000      -1.034200    
 H   0.7510000      -1.632600       1.813100    
 H    1.013300      2.9100001E-02   1.414500    
 H    3.446500      0.4872000     -8.7600000E-02
 H    2.972300      6.8300001E-02   1.561700    
 H    3.782700      -1.363400      -1.738900    
 H    4.757000      -2.296000     -0.5961000    
 H   -1.229000      -2.805200       1.154600    
 H   -3.017400       1.466700     -0.6329000    
 H    5.250700      0.4416000       1.691700    
 H    5.055300      -1.307300       1.820800    
 H    5.639000     -0.5660000      0.3091000    
 H    2.968600      -4.095300     -0.5951000    
 H    2.265200      -3.268800      -2.011000    
 H    3.907700      -3.877600      -2.071600    
 H   -3.558100      -2.652200      0.5738000    
 H  -0.7678000       2.369300       1.911900    
 H   0.1478000       1.073800      -2.103100    
 H   0.6977000       4.328900       1.602700    
 H    1.613400       3.035100      -2.391300    
 H    1.892000       4.668700     -0.5451000    
 H   -5.252400      -2.451000     -0.8573000    
 H   -6.599500      -1.363600     -0.5389000    
 H   -5.639800      -1.904600      0.8340000    


%chk=000027180-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027180

0 1
O -4.790965 -0.422258 -0.603015
N 3.021804 -1.463313 -0.024552
C 1.579700 -1.279239 -0.326295
C 0.737332 -1.041665 0.959472
C -0.736611 -0.834144 0.636924
C 3.735917 -0.168122 0.149087
C 3.708428 -2.376206 -0.977070
C -1.261191 0.408934 0.149078
C -1.615928 -1.940245 0.711763
C -0.431394 1.655076 0.052389
C -2.613495 0.483928 -0.257383
C 4.971421 -0.281604 1.062938
C 3.360014 -3.859126 -0.745295
C -2.972179 -1.867463 0.321450
C -3.468964 -0.639695 -0.175258
C 0.191892 2.218123 1.199093
C -0.297028 2.333141 -1.189104
C 0.939551 3.412574 1.103806
C 0.451381 3.527431 -1.286864
C 1.076848 4.070578 -0.140971
C -5.714408 -1.555400 -0.528567
H 1.198252 -2.189085 -0.824460
H 1.409668 -0.433299 -1.036898
H 0.867188 -1.923266 1.612784
H 1.160915 -0.178651 1.500358
H 4.033069 0.265840 -0.839535
H 3.028600 0.553208 0.598526
H 3.491259 -2.098261 -2.040647
H 4.797711 -2.247957 -0.838532
H -1.223637 -2.895630 1.081834
H -3.031293 1.428908 -0.618786
H 5.457067 0.705357 1.182112
H 4.672618 -0.653969 2.058325
H 5.725896 -0.978129 0.653536
H 3.629492 -4.154947 0.283658
H 2.281108 -4.054922 -0.883863
H 3.910830 -4.502572 -1.457081
H -3.610695 -2.751702 0.407145
H 0.060885 1.734241 2.173845
H -0.774000 1.910503 -2.081166
H 1.404321 3.835065 2.001970
H 0.547379 4.031538 -2.255294
H 1.657098 4.997153 -0.215142
H -5.373308 -2.397321 -1.162728
H -6.672873 -1.171153 -0.907682
H -5.840373 -1.906456 0.514597


