%chk=000056847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056847

0 1
 O   -1.449800       1.085100      4.2700000E-02
 O    4.705100      0.3010000      0.7961000    
 O  -0.8468000       3.291200     -0.2205000    
 N   -5.915300     -0.7850000     -0.1074000    
 C   -7.278200     -0.6679000     -0.6440000    
 C   -7.984000      -1.881400     -3.5399999E-02
 C   -6.093500      -1.170200       1.294700    
 C   -7.206300      -2.203500       1.236000    
 C   -5.139000      0.4431000     -0.2295000    
 C   -7.333000     -0.6869000      -2.166400    
 C   -3.653200      0.1505000     -4.8099998E-02
 C   -2.817400       1.419400     -0.1487000    
 C    6.420200     -4.6799999E-02 -0.8361000    
 C    5.210200     -0.6618000     -0.1254000    
 C    7.233600      -1.110600      -1.565000    
 C    7.724600      -2.189600     -0.5964000    
 C    5.543600      -1.934400      0.5990000    
 C    6.681100      -2.613700      0.3944000    
 C  -0.5663000       2.120000     -1.8400000E-02
 C    3.432200      0.7401000      0.5976000    
 C   0.8226000       1.640400      0.1951000    
 C    3.188900       2.094900      0.3715000    
 C    2.370700     -0.1645000      0.6226000    
 C    1.884100       2.545000      0.1703000    
 C    1.065900      0.2857000      0.4214000    
 H   -7.762400      0.2460000     -0.2725000    
 H   -9.032900      -1.657300      0.1870000    
 H   -7.965000      -2.749200     -0.7059000    
 H   -5.187700      -1.599200       1.733800    
 H   -6.414400     -0.3235000       1.915200    
 H   -6.792700      -3.216700       1.169700    
 H   -7.844400      -2.159200       2.124400    
 H   -5.260200      0.8729000      -1.230600    
 H   -5.477700       1.210700      0.4782000    
 H   -6.805100      -1.555400      -2.576000    
 H   -8.372000     -0.7361000      -2.510000    
 H   -6.886500      0.2133000      -2.599400    
 H   -3.455200     -0.3151000      0.9251000    
 H   -3.308800     -0.5713000     -0.8002000    
 H   -2.946600       1.876700      -1.136800    
 H   -3.128200       2.135400      0.6214000    
 H    6.080300      0.7206000      -1.542300    
 H    7.058300      0.4780000     -0.1122000    
 H    4.461600     -0.9099000     -0.8916000    
 H    8.090200     -0.6510000      -2.070800    
 H    6.613500      -1.571300      -2.344600    
 H    8.596000      -1.820300     -4.2700000E-02
 H    8.055800      -3.061200      -1.172200    
 H    4.824100      -2.319800       1.315900    
 H    6.867900      -3.519200      0.9642000    
 H    4.012100       2.803800      0.3509000    
 H    2.540900      -1.221200      0.8079000    
 H    1.715800       3.604200     -4.1999999E-03
 H   0.2695000     -0.4524000      0.4515000    


%chk=000056847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056847

0 1
O -1.485273 1.118547 -0.116101
O 4.937982 0.800582 -0.249186
O -0.985749 3.378766 0.175150
N -6.028783 -0.814844 -0.145854
C -7.505339 -0.594578 -0.273102
C -8.095121 -2.007796 -0.008746
C -5.874921 -1.728646 1.018136
C -7.019810 -2.758119 0.841688
C -5.236364 0.428491 -0.045539
C -7.912579 -0.006967 -1.633425
C -3.715881 0.164006 -0.097525
C -2.930388 1.475611 -0.082187
C 6.858975 -0.388857 -1.104271
C 5.433623 -0.576114 -0.564395
C 7.575224 -1.755798 -1.194764
C 7.706151 -2.407190 0.204026
C 5.406034 -1.445531 0.679331
C 6.437376 -2.260133 1.025148
C -0.592434 2.193131 0.020132
C 3.563107 1.032567 -0.175982
C 0.824974 1.758631 -0.043344
C 3.194427 2.388320 0.039660
C 2.557964 0.036151 -0.312058
C 1.840767 2.744318 0.102899
C 1.200413 0.406978 -0.247944
H -7.855383 0.098029 0.539649
H -9.069985 -1.938476 0.505445
H -8.261068 -2.526547 -0.970026
H -4.877695 -2.201237 1.023196
H -5.995064 -1.173126 1.985585
H -6.656526 -3.648755 0.301228
H -7.410113 -3.094979 1.817984
H -5.511889 1.081986 -0.895048
H -5.483276 0.992960 0.895187
H -7.520367 -0.641914 -2.448260
H -9.014230 0.033446 -1.717777
H -7.532595 1.020727 -1.779680
H -3.398254 -0.449530 0.765509
H -3.482963 -0.407027 -1.014590
H -3.154586 2.109035 -0.961376
H -3.126535 2.073568 0.827582
H 6.822618 0.110390 -2.089018
H 7.404878 0.280063 -0.412575
H 4.778845 -0.992133 -1.360106
H 8.573828 -1.628730 -1.651848
H 7.000826 -2.429935 -1.861436
H 8.546705 -1.942221 0.762101
H 7.967606 -3.479748 0.108013
H 4.513782 -1.381427 1.314626
H 6.368593 -2.847206 1.951767
H 3.987960 3.134072 0.143655
H 2.817544 -1.015047 -0.463854
H 1.540235 3.785110 0.261243
H 0.418933 -0.350472 -0.355622


