%chk=000004501.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004501

1 1
 O    5.514200      -1.412500      0.1150000    
 O    6.120500      0.9086000     -9.5500000E-02
 O   -5.128300       1.683800     -0.1389000    
 O   -5.703100      -1.022400      0.1066000    
 N   0.2704000      -1.625600      0.1453000    
 C   0.6798000     -0.3448000      2.9100001E-02
 C  -0.3226000      0.6631000     -5.9500001E-02
 C    2.074900     -3.0099999E-02 -2.3000001E-03
 C   -1.708000      0.2869000     -2.2399999E-02
 C    2.460300       1.336900     -0.1267000    
 C   -2.035200      -1.079200      0.1014000    
 C   -1.008800      -2.005600      0.1822000    
 C   0.1220000       1.994600     -0.1807000    
 C    3.107000     -0.9994000      8.2900003E-02
 C    1.477900       2.323300     -0.2135000    
 C    3.816700       1.708600     -0.1632000    
 C    4.427700     -0.5958000      4.3900002E-02
 C   -2.795700       1.194100     -0.1015000    
 C    4.773400      0.7228000     -7.6300003E-02
 C   -3.373500      -1.505300      0.1435000    
 C    1.107800      -2.819600      0.2495000    
 C   -4.125500      0.7648000     -5.8800001E-02
 C   -4.414400     -0.5862000      6.3699998E-02
 C    6.585400     -0.4512000      2.6100000E-02
 C   -5.601700       2.234800       1.088300    
 C   -6.321300      -1.344500      -1.138300    
 H   -1.251700      -3.060800      0.2780000    
 H  -0.5812000       2.820300     -0.2535000    
 H    3.067100      -2.061000      0.1797000    
 H    1.752200       3.372600     -0.3088000    
 H    4.115400       2.749000     -0.2577000    
 H   -2.620600       2.262800     -0.1996000    
 H   -3.609700      -2.563900      0.2404000    
 H    1.655400      -2.947600     -0.6887000    
 H    1.658300      -2.781000       1.193800    
 H   0.5267000      -3.746600      0.3321000    
 H    7.201500     -0.6914000     -0.8480000    
 H    7.205100     -0.5315000      0.9267000    
 H   -6.006400       1.448400       1.733200    
 H   -6.401100       2.944700      0.8592000    
 H   -4.797200       2.767800       1.604900    
 H   -7.345800      -1.669800     -0.9378000    
 H   -5.785000      -2.160600      -1.632700    
 H   -6.354200     -0.4662000      -1.790700    


%chk=000004501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004501

1 1
O 5.641526 -1.403388 -0.644803
O 6.253211 0.905087 -0.414310
O -4.986406 1.811711 -0.102037
O -5.709177 -1.057558 -0.181552
N 0.328683 -1.758532 0.527165
C 0.773383 -0.428779 0.259055
C -0.236307 0.596883 0.191129
C 2.178238 -0.102092 0.068089
C -1.649422 0.248741 0.147347
C 2.549732 1.304949 0.103831
C -2.011385 -1.148836 0.220991
C -0.990785 -2.089885 0.465265
C 0.185063 1.967537 0.169277
C 3.207042 -1.070506 -0.224543
C 1.526421 2.306702 0.188099
C 3.918284 1.722281 -0.022289
C 4.512047 -0.626008 -0.355563
C -2.699045 1.197578 0.047305
C 4.875063 0.746451 -0.231850
C -3.378051 -1.557736 0.109030
C 1.228447 -2.825491 1.077003
C -4.046772 0.798753 -0.010713
C -4.389433 -0.613767 -0.047222
C 6.796626 -0.455985 -0.694714
C -6.185851 1.778028 0.789467
C -6.367244 -0.738892 -1.482901
H -1.236007 -3.136266 0.664438
H -0.564052 2.761409 0.155254
H 2.995712 -2.120128 -0.415759
H 1.825136 3.359681 0.213599
H 4.178811 2.782622 0.016156
H -2.512344 2.273343 0.034908
H -3.650701 -2.618059 0.116880
H 1.604258 -3.484280 0.277976
H 2.070118 -2.365676 1.610744
H 0.649547 -3.427100 1.794005
H 7.227011 -0.469008 -1.708437
H 7.515581 -0.725942 0.094531
H -6.643713 0.776813 0.814953
H -6.873147 2.521572 0.363398
H -5.872602 2.084552 1.802217
H -7.401405 -1.093238 -1.372914
H -5.860118 -1.288493 -2.295380
H -6.347274 0.346254 -1.686727


