%chk=000026455.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026455

0 1
 O   -1.339000     -0.1201000      0.7346000    
 O  -0.8677000      -2.801400       1.364000    
 O   -3.210200     -0.6771000      -1.384900    
 O    6.129400       1.491600     -0.7856000    
 N    1.959800     -0.8577000     -4.8799999E-02
 C  -0.1699000      -2.153700      0.2883000    
 C   -1.085100      -1.086700     -0.2941000    
 C    1.113400      -1.560100      0.9079000    
 C   -2.401200      -1.686000     -0.7721000    
 C   0.1568000      -3.226100     -0.7601000    
 C    3.177800     -0.3781000      0.5892000    
 C   -2.359000      0.7317000      0.4017000    
 C   -3.259100      0.4669000     -0.6327000    
 C    4.056800      0.3464000     -0.4252000    
 C   -2.482400       1.900200       1.153700    
 C   -4.256600       1.391100     -0.9445000    
 C    5.350000      0.8411000      0.2085000    
 C   -3.488700       2.817600      0.8502000    
 C   -4.371100       2.565900     -0.2010000    
 C    7.345800       1.994400     -0.2492000    
 H  -0.5945000     -0.5673000      -1.128800    
 H   0.8503000     -0.8928000       1.739600    
 H    1.680200      -2.381200       1.368700    
 H   -2.251300      -2.451000      -1.537900    
 H   -2.981600      -2.132100      4.5400001E-02
 H   0.9199000      -3.913600     -0.3756000    
 H  -0.7078000      -3.858300     -0.9866000    
 H   0.5346000      -2.789100      -1.689900    
 H    1.452700     -6.9300003E-02 -0.4482000    
 H    2.932800      0.3056000       1.411200    
 H    3.737900      -1.222100       1.009500    
 H   -1.122800      -2.118400       2.007900    
 H    3.519700       1.198700     -0.8613000    
 H    4.298200     -0.3171000      -1.265900    
 H   -1.793900       2.107900       1.968200    
 H   -4.953400       1.198900      -1.755700    
 H    5.125700       1.545200       1.018500    
 H    5.915100     -3.3000000E-03  0.6205000    
 H   -3.582700       3.731200       1.430100    
 H   -5.151000       3.283800     -0.4378000    
 H    7.902800       2.479700      -1.055100    
 H    7.953900       1.178400      0.1533000    
 H    7.144000       2.735000      0.5308000    


%chk=000026455-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026455

0 1
O -1.715945 -0.086459 0.919916
O -0.819706 -2.580979 1.674597
O -2.798483 -0.644834 -1.725227
O 6.129088 1.405744 -1.125033
N 1.834003 -0.028138 0.740401
C -0.004838 -1.776650 0.738014
C -0.937354 -0.862531 -0.098145
C 0.976221 -0.891909 1.574385
C -1.920577 -1.602706 -1.010432
C 0.752971 -2.783059 -0.135135
C 3.287739 -0.287445 0.766355
C -2.824398 0.624499 0.401272
C -3.343008 0.356044 -0.894351
C 4.023696 0.647758 -0.214026
C -3.408716 1.622603 1.206202
C -4.428511 1.110003 -1.385735
C 5.542446 0.452470 -0.178176
C -4.504597 2.366852 0.717051
C -5.007594 2.116461 -0.583163
C 7.585989 1.311225 -1.174250
H -0.321010 -0.152149 -0.681266
H 0.368853 -0.282648 2.272127
H 1.585675 -1.583398 2.190972
H -1.395260 -2.145511 -1.810178
H -2.540089 -2.305447 -0.421385
H 1.432267 -3.376176 0.501219
H 0.060278 -3.486693 -0.626989
H 1.349453 -2.258605 -0.901576
H 1.621984 0.969493 0.849636
H 3.724795 -0.166769 1.790432
H 3.459349 -1.341442 0.472744
H -1.425887 -1.947668 2.145065
H 3.802543 1.705570 0.033967
H 3.654068 0.474050 -1.240548
H -2.991155 1.807173 2.201246
H -4.806459 0.886661 -2.388255
H 5.941063 0.636630 0.846667
H 5.813428 -0.589121 -0.468443
H -4.957011 3.141706 1.344513
H -5.851985 2.696917 -0.969013
H 7.921699 2.061660 -1.907204
H 7.919749 0.302836 -1.501760
H 8.043830 1.532679 -0.185690


