%chk=000025147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025147

0 1
 O   -3.424600      -1.569600     -0.9514000    
 O   0.8264000      0.5747000       2.128900    
 O    2.247900      -2.502700      -1.029700    
 N    1.235400      -1.251800      0.6956000    
 N   -3.668900      0.6290000     -0.2545000    
 C   0.2438000      -2.183200       1.158800    
 C   -1.061300      -2.086900      0.3751000    
 C   -1.713600     -0.7058000      0.4896000    
 C   -3.008800     -0.6035000     -0.3063000    
 C    2.525900      0.6107000      0.4766000    
 C    2.950700     -0.3114000     -0.4685000    
 C    1.420900      1.4900000E-02   1.226500    
 C    2.123300      -1.510100     -0.3365000    
 C   -4.914100      0.8079000     -0.9911000    
 C   -3.220500       1.796800      0.5004000    
 C    3.115000       1.852000      0.6019000    
 C    3.986900     -4.0700000E-02  -1.338400    
 C   -6.116300      0.4388000     -0.1468000    
 C   -2.315000       2.681300     -0.3317000    
 C    4.167600       2.148300     -0.2688000    
 C    4.599200       1.211300      -1.229700    
 H   -1.755100      -2.853100      0.7420000    
 H  -0.8720000      -2.313600     -0.6820000    
 H   5.1899999E-02  -1.998200       2.221800    
 H   0.6460000      -3.197500       1.056300    
 H   -1.930400     -0.5068000       1.544200    
 H   -1.036400      6.0699999E-02  0.1069000    
 H   -4.988300       1.844100      -1.339000    
 H   -4.897800      0.1708000      -1.882600    
 H   -4.094200       2.362700      0.8426000    
 H   -2.685300       1.479700       1.398900    
 H    2.782900       2.572700       1.339800    
 H    4.318700     -0.7605000      -2.077300    
 H   -6.062500     -0.6040000      0.1833000    
 H   -6.183100       1.066700      0.7475000    
 H   -7.038900      0.5668000     -0.7214000    
 H   -1.429100       2.144200     -0.6824000    
 H   -2.838400       3.062100      -1.214900    
 H   -1.979000       3.540500      0.2572000    
 H    4.661600       3.114500     -0.2064000    
 H    5.420000       1.468200      -1.894400    


%chk=000025147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025147

0 1
O -3.775156 -1.689545 -0.574904
O 0.844194 0.369938 2.278791
O 2.261561 -2.467332 -1.205688
N 1.282370 -1.266160 0.602313
N -3.804981 0.610588 -0.255528
C 0.218553 -2.232159 0.939276
C -1.080105 -2.038215 0.127268
C -1.745712 -0.669069 0.368088
C -3.177746 -0.629625 -0.194503
C 2.702979 0.582018 0.633205
C 3.126922 -0.266394 -0.418376
C 1.517712 -0.048368 1.302417
C 2.227492 -1.466384 -0.448810
C -5.191648 0.670969 -0.780389
C -3.193428 1.880888 0.194678
C 3.364542 1.786402 0.914417
C 4.226788 0.061230 -1.224595
C -6.251688 0.499112 0.328459
C -2.536032 2.681480 -0.953149
C 4.478539 2.128394 0.103541
C 4.902771 1.279133 -0.949807
H -1.791440 -2.835778 0.408042
H -0.872998 -2.178932 -0.949121
H 0.018426 -2.122460 2.020891
H 0.627443 -3.240800 0.751129
H -1.778515 -0.460059 1.457065
H -1.136276 0.139237 -0.078208
H -5.321706 1.639953 -1.298617
H -5.301588 -0.138025 -1.522140
H -3.989350 2.491242 0.663049
H -2.452506 1.676234 0.985376
H 3.030579 2.432022 1.732690
H 4.547271 -0.603535 -2.032824
H -6.144740 -0.492132 0.800425
H -6.152436 1.274278 1.110926
H -7.269350 0.572590 -0.097513
H -1.704047 2.114214 -1.407175
H -3.267693 2.905185 -1.750082
H -2.135904 3.640524 -0.575474
H 5.021161 3.060690 0.293204
H 5.766244 1.568652 -1.558247


