%chk=000021774.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021774

0 1
 O   0.1150000      -1.116300      -1.843200    
 O    1.634400      0.6681000     -0.3079000    
 O    3.314500      0.9474000       1.241100    
 N    3.372800       2.004400     -0.8001000    
 C  -8.3300002E-02  -1.053900     -0.4151000    
 C    1.286800     -0.6279000      0.1935000    
 C  -0.5057000      -2.486400      1.6100001E-02
 C   -1.237700     -7.8599997E-02 -0.1577000    
 C    2.440000      -1.572500     -0.1514000    
 C  -0.8162000      -2.663400       1.496800    
 C   -1.306900      0.5481000       1.063600    
 C   -2.156400      0.1291000      -1.158900    
 C   -2.357400       1.435400       1.297900    
 C   -3.206900       1.016200     -0.9245000    
 C   -3.307400       1.669500      0.3037000    
 C    2.814200       1.181000      0.1460000    
 H    1.216100     -0.5694000       1.285200    
 H   -1.398400      -2.781700     -0.5537000    
 H   0.2521000      -3.216900     -0.2886000    
 H    3.384400      -1.286400      0.3200000    
 H    2.628500      -1.590100      -1.230600    
 H    2.240900      -2.593900      0.1832000    
 H   -1.019800      -3.719800       1.703600    
 H   -1.705100      -2.103900       1.799600    
 H   2.5100000E-02  -2.363300       2.127100    
 H   0.4997000     -0.2690000      -2.127800    
 H  -0.5951000      0.3775000       1.862500    
 H   -2.116800     -0.3772000      -2.117500    
 H   -2.438200       1.941300       2.255600    
 H   -3.949500       1.195300      -1.696700    
 H   -4.126400       2.358900      0.4867000    
 H    2.920000       2.165800      -1.693300    
 H    4.256000       2.475500     -0.6355000    


%chk=000021774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021774

0 1
O 0.155485 -1.344432 -1.967881
O 1.864545 0.352174 -0.578125
O 2.436938 1.303420 1.508403
N 2.800837 2.423294 -0.519997
C -0.004336 -1.193591 -0.498552
C 1.398208 -0.901794 0.107008
C -0.557386 -2.573437 -0.047867
C -1.028069 -0.074354 -0.204529
C 2.447680 -1.985984 -0.152377
C -0.733966 -2.742152 1.475114
C -0.973708 0.759824 0.941685
C -2.115478 0.083717 -1.104205
C -1.978232 1.727232 1.176873
C -3.119125 1.047551 -0.869268
C -3.055404 1.876028 0.275304
C 2.377681 1.367080 0.254281
H 1.337312 -0.680824 1.186175
H -1.532388 -2.703818 -0.552825
H 0.112625 -3.354088 -0.452321
H 3.441654 -1.625280 0.163349
H 2.479573 -2.250714 -1.222411
H 2.220762 -2.897026 0.429082
H -1.198400 -3.719511 1.696647
H -1.386675 -1.955274 1.893071
H 0.231336 -2.705632 2.013778
H 0.565743 -0.501003 -2.295570
H -0.148302 0.681665 1.657667
H -2.156149 -0.553499 -1.994051
H -1.913144 2.364706 2.065956
H -3.949465 1.152787 -1.577156
H -3.832543 2.626206 0.460632
H 2.705634 2.395901 -1.531972
H 3.180058 3.243730 -0.056219


