%chk=000004389.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004389

0 1
 O    3.535400       1.899300      0.1083000    
 O  -0.2625000       1.561500      0.6592000    
 O    2.456600      0.8567000      -1.607900    
 O   -5.096100      0.8037000      3.1700000E-02
 O   -4.150700      -1.211600     -0.4253000    
 N   0.8741000     -0.4061000      0.2201000    
 C    2.184500      5.7300001E-02  0.6574000    
 C    3.016900      -1.211900      0.7985000    
 C    2.396200      -2.159000     -0.2254000    
 C   0.9159000      -1.813400     -0.1690000    
 C  -0.2660000      0.3749000      0.3274000    
 C    2.717000      0.9556000     -0.4180000    
 C   -1.562700     -0.3192000     -5.4000001E-03
 C   -2.719000      0.6472000      0.1535000    
 C   -4.039600     -3.5200000E-02 -0.1054000    
 H    2.083200      0.6151000       1.594500    
 H    2.886900      -1.630700       1.803900    
 H    4.086400      -1.058700      0.6255000    
 H    2.795900      -1.943800      -1.223500    
 H    2.590400      -3.212100     -3.5999999E-03
 H   0.4113000      -1.968700      -1.126400    
 H   0.4030000      -2.394200      0.6052000    
 H   -1.688900      -1.177700      0.6640000    
 H   -1.521100     -0.6874000      -1.036400    
 H   -2.747200       1.049500       1.173000    
 H   -2.622100       1.479900     -0.5528000    
 H    3.896000       2.497200     -0.5808000    
 H   -5.948100      0.3524000     -0.1491000    


%chk=000004389-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004389

0 1
O 3.568780 1.920068 -0.095836
O -0.173925 1.561274 0.599790
O 2.309247 0.849463 -1.731293
O -5.175439 0.744650 0.198670
O -4.127150 -0.607660 -1.367821
N 0.856246 -0.493252 0.373526
C 2.181183 0.097565 0.641913
C 3.096345 -1.151921 0.802681
C 2.446466 -2.191729 -0.146245
C 0.927639 -1.935468 0.015438
C -0.265716 0.313238 0.359718
C 2.639895 0.971047 -0.534072
C -1.594812 -0.371592 0.028782
C -2.785610 0.535642 0.374335
C -4.043040 0.139055 -0.366021
H 2.157639 0.735240 1.539953
H 3.048511 -1.494551 1.852047
H 4.149189 -0.935109 0.560212
H 2.749152 -1.993881 -1.189093
H 2.721626 -3.229101 0.105739
H 0.370066 -2.141353 -0.914744
H 0.497339 -2.558685 0.825165
H -1.673704 -1.343218 0.551263
H -1.619383 -0.605067 -1.054708
H -2.993663 0.555109 1.458081
H -2.529490 1.580868 0.109402
H 3.866326 2.473927 -0.867612
H -5.978016 0.496038 -0.336069


