%chk=000002385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002385

0 1
 O   0.2510000      -3.322000       1.137200    
 O  -0.1460000      -3.325200      -1.145100    
 N   -1.656400     -0.7796000     -0.7634000    
 N    1.645900     -0.7738000      0.7672000    
 N   -2.019400      -1.668400       1.241100    
 N    2.010900      -1.666300      -1.235300    
 N   -6.795700       2.557900      0.1136000    
 N    6.777000       2.574100     -0.1175000    
 N   -5.470800       2.672600      -1.808000    
 N    5.451800       2.690000       1.803800    
 C  -3.1999999E-03  -2.458600      3.8999999E-03
 C   -1.225700      -1.655600      0.1937000    
 C    1.275700      -1.614500     -0.1971000    
 C   -2.804400     -0.1875000     -0.3029000    
 C    2.792500     -0.1801000      0.3054000    
 C   -3.010000     -0.7590000      0.9497000    
 C    2.999400     -0.7539000     -0.9460000    
 C   -3.654700      0.7694000     -0.8578000    
 C    3.640400      0.7803000      0.8580000    
 C   -4.125000     -0.3639000       1.708000    
 C    4.113400     -0.3579000      -1.705200    
 C   -4.759500       1.151100     -8.9400001E-02
 C    4.744300       1.162700      8.8699996E-02
 C   -4.992300      0.5957000       1.171000    
 C    4.978500      0.6051000      -1.170400    
 C   -5.681900       2.146000     -0.6153000    
 C    5.664200       2.161200      0.6122000    
 H   -1.211100     -0.5987000      -1.653400    
 H    1.193900     -0.5979000       1.655700    
 H   -3.445300       1.181000      -1.838900    
 H    3.430000       1.193600       1.838100    
 H   -4.313700     -0.7900000       2.688300    
 H    4.303200     -0.7858000      -2.684400    
 H    1.181700      -3.601600       1.106000    
 H   -1.059500      -3.658400      -1.157300    
 H   -5.840700      0.8731000       1.787800    
 H    5.826200      0.8832000      -1.787900    
 H   -7.427800       3.252000     -0.2718000    
 H   -7.033500       2.208000       1.033000    
 H    7.407500       3.270700      0.2664000    
 H    7.015700       2.222600      -1.036000    
 H   -6.221400       3.345000      -2.000900    
 H    6.200900       3.364600       1.995200    


%chk=000002385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002385

0 1
O 0.196699 -2.399439 2.176306
O 0.176217 -3.162296 -0.104366
N -1.554258 -0.316779 -0.295451
N 2.468917 -1.297624 1.003173
N -2.370512 -1.744941 1.294435
N 1.199735 -0.105686 -0.466046
N -7.194852 2.232158 -0.516852
N 7.140010 2.558820 -0.301963
N -5.603735 2.422070 -2.330922
N 7.479956 0.356151 0.641939
C 0.056090 -1.995671 0.786420
C -1.289655 -1.331687 0.602524
C 1.222445 -1.109626 0.432763
C -2.921913 -0.029453 -0.193654
C 3.336350 -0.350522 0.441081
C -3.423516 -0.939403 0.808543
C 2.520310 0.392350 -0.484019
C -3.746567 0.901364 -0.845736
C 4.697600 -0.073488 0.641145
C -4.794241 -0.920413 1.147408
C 3.096634 1.434674 -1.241875
C -5.114046 0.922049 -0.487544
C 5.261654 0.981560 -0.112138
C -5.623468 0.010194 0.493938
C 4.461955 1.715602 -1.047341
C -6.000771 1.918624 -1.177096
C 6.716887 1.286904 0.100272
H -0.782576 0.135192 -0.817041
H 2.662688 -1.987770 1.728311
H -3.398004 1.592769 -1.617753
H 5.345631 -0.628809 1.324979
H -5.193549 -1.620425 1.886928
H 2.497888 1.991416 -1.968339
H -0.727994 -2.506825 2.542556
H -0.601812 -3.756695 0.070965
H -6.696914 -0.006365 0.713692
H 4.926974 2.486610 -1.671751
H -7.864305 2.865301 -0.948810
H -7.361632 1.947369 0.445367
H 8.122050 2.815313 -0.228295
H 6.476303 3.287232 -0.554336
H -6.257374 3.132571 -2.720112
H 8.464800 0.658821 0.788694


