%chk=000018538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018538

0 1
 O   -1.778300      -1.632800      -1.444000    
 O    2.899900       1.637100      -1.011700    
 O    3.925900     -0.2241000      0.7799000    
 N   -3.852800     -0.4416000      3.9799999E-02
 C   -2.464000     -0.2918000      0.4947000    
 C   -1.510700     -0.4332000     -0.7189000    
 C   -2.310700       1.048600       1.241200    
 C  -4.8099998E-02 -0.3742000     -0.3182000    
 C   -2.558800       2.262600      0.3520000    
 C   0.7558000      0.6129000     -0.8557000    
 C   0.4414000      -1.309200      0.5739000    
 C    2.100000      0.6674000     -0.4870000    
 C    1.785600      -1.255000      0.9423000    
 C    2.615000     -0.2667000      0.4119000    
 H   -2.289300      -1.108200       1.204700    
 H   -1.714900      0.3714000      -1.435500    
 H   -1.309400       1.124300       1.680400    
 H   -3.012900       1.080000       2.084200    
 H   -4.058600      0.2263000     -0.7010000    
 H   -4.493700     -0.2341000      0.8043000    
 H   -2.472800       3.174000      0.9542000    
 H   -1.825000       2.345600     -0.4532000    
 H   -3.561600       2.261000     -8.3999999E-02
 H   0.3543000       1.339000      -1.557100    
 H  -0.1884000      -2.091400      0.9863000    
 H   -2.727000      -1.639200      -1.657100    
 H    2.174300      -1.990400       1.641700    
 H    2.373300       2.192000      -1.612400    
 H    4.102400     -0.9461000       1.407200    


%chk=000018538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018538

0 1
O -1.912885 -1.733526 -1.191008
O 3.010318 1.788014 -0.420613
O 4.074658 -0.393636 0.788128
N -3.799961 -0.536367 0.178999
C -2.423389 -0.077829 0.528895
C -1.502187 -0.418976 -0.706456
C -2.323506 1.394459 1.008536
C -0.027832 -0.441224 -0.337343
C -2.868169 2.451892 0.020677
C 0.796791 0.685209 -0.576322
C 0.538768 -1.579775 0.279480
C 2.157335 0.694149 -0.197825
C 1.898311 -1.579855 0.658975
C 2.716771 -0.450066 0.433670
H -2.080407 -0.734718 1.352340
H -1.671537 0.345549 -1.498747
H -1.261429 1.612551 1.231865
H -2.870837 1.483761 1.968219
H -4.334816 0.142243 -0.376122
H -4.344721 -0.877263 0.976990
H -2.761339 3.465925 0.445944
H -2.328539 2.435425 -0.943695
H -3.944810 2.305041 -0.193080
H 0.378819 1.568108 -1.082157
H -0.082267 -2.469736 0.415601
H -2.892892 -1.758301 -0.930685
H 2.335821 -2.471494 1.128430
H 2.522313 2.506412 -0.895501
H 4.352517 -1.251773 1.195703


