%chk=000080733.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080733

0 1
 O   -5.627500       2.656900      9.3999999E-03
 O    5.627500       2.657000     -6.8999999E-03
 O   -9.997000      -1.843400     -1.4000000E-03
 O    9.996700      -1.843700      9.8000001E-03
 O   -9.927500      0.3508000      5.2999998E-03
 O    9.927800      0.3504000      2.4999999E-03
 N   -9.354000     -0.7655000      1.2000001E-03
 N    9.354100     -0.7658000      5.2999998E-03
 C   -1.436700      0.3133000     -1.1000000E-03
 C    1.436700      0.3134000     -2.4999999E-03
 C  -0.7179000     -0.9058000     -2.4000001E-03
 C   0.7178000     -0.9057000     -2.6000000E-03
 C  -0.7178000       1.539800     -7.9999998E-04
 C   0.7179000       1.539700     -2.0999999E-03
 C   -2.879200      0.3053000       0.000000    
 C    2.879200      0.3054000     -2.7000001E-03
 C   -3.607200     -0.9090000     -1.2000001E-03
 C    3.607100     -0.9089000     -1.6000000E-03
 C   -3.559000       1.532800      2.4999999E-03
 C    3.559000       1.533000     -3.7000000E-03
 C   -1.479000      -2.091700     -3.1999999E-03
 C    1.479000      -2.091600     -2.4000001E-03
 C   -1.477800       2.731500      1.0000000E-03
 C    1.477800       2.731600     -2.9000000E-03
 C   -5.093900     -0.9032000     -1.0000000E-03
 C    5.093900     -0.9031000       0.000000    
 C   -2.873000      -2.095700     -2.6000000E-03
 C    2.872900      -2.095600     -1.6000000E-03
 C   -2.866700       2.735900      2.9000000E-03
 C    2.866700       2.736100     -4.0000002E-03
 C   -5.793900      0.3155000      2.6000000E-03
 C    5.793800      0.3156000     -2.0999999E-03
 C   -5.038300       1.582900      5.5999998E-03
 C    5.038400       1.583000     -4.9999999E-03
 C   -5.876000      -2.075800     -4.4000000E-03
 C    5.876000      -2.075600      3.7000000E-03
 C   -7.196900      0.3668000      3.4000000E-03
 C    7.196900      0.3669000     -8.9999998E-04
 C   -7.935300     -0.8105000      9.9999997E-05
 C    7.935300     -0.8104000      2.4999999E-03
 C   -7.275100      -2.031400     -3.8999999E-03
 C    7.275000      -2.031300      4.9999999E-03
 H   -1.009500      -3.071700     -4.4000000E-03
 H    1.009500      -3.071600     -2.2000000E-03
 H   -1.006700       3.710400      1.6000000E-03
 H    1.006600       3.710400     -3.1000001E-03
 H   -3.353000      -3.069800     -3.4000000E-03
 H    3.353000      -3.069800     -1.2000001E-03
 H   -3.382300       3.692400      4.8000002E-03
 H    3.382300       3.692600     -4.6999999E-03
 H   -5.423600      -3.063300     -7.7000000E-03
 H    5.423600      -3.063200      5.9000002E-03
 H   -7.695600       1.333100      6.3999998E-03
 H    7.695600       1.333300     -2.3000001E-03
 H   -7.812000      -2.977000     -6.6000000E-03
 H    7.811900      -2.976800      8.2000000E-03


%chk=000080733-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080733

0 1
O -5.718136 2.748827 0.000558
O 5.718115 2.748838 0.000122
O -10.044028 -1.951347 -0.002780
O 10.044029 -1.951337 0.002679
O -10.014721 0.331020 -0.001227
O 10.014731 0.331026 0.001310
N -9.425269 -0.816054 -0.001771
N 9.425260 -0.816044 0.001739
C -1.455902 0.329727 0.000326
C 1.455885 0.329731 -0.000698
C -0.735282 -0.920045 -0.000179
C 0.735268 -0.920043 -0.000574
C -0.737701 1.581900 0.000340
C 0.737681 1.581903 -0.000282
C -2.904338 0.326824 0.000841
C 2.904320 0.326831 -0.001260
C -3.634331 -0.918422 0.000496
C 3.634316 -0.918414 -0.001255
C -3.606963 1.579006 0.001443
C 3.606945 1.579014 -0.001496
C -1.484341 -2.119574 -0.000327
C 1.484330 -2.119570 -0.000790
C -1.479598 2.789244 0.000924
C 1.479577 2.789248 -0.000477
C -5.108510 -0.909856 0.000278
C 5.108496 -0.909845 -0.000937
C -2.891312 -2.119164 -0.000089
C 2.891301 -2.119157 -0.001014
C -2.884604 2.787568 0.001451
C 2.884584 2.787575 -0.001056
C -5.818117 0.335598 0.000783
C 5.818101 0.335610 -0.001081
C -5.092017 1.637193 0.002667
C 5.091998 1.637204 -0.002954
C -5.877436 -2.113200 -0.000939
C 5.877422 -2.113188 0.000145
C -7.232061 0.367286 0.000068
C 7.232045 0.367300 -0.000156
C -7.941969 -0.840035 -0.001092
C 7.941953 -0.840022 0.000848
C -7.277392 -2.091006 -0.001600
C 7.277378 -2.090993 0.001015
H -0.976526 -3.086754 -0.000804
H 0.976518 -3.086752 -0.000590
H -0.966850 3.753333 0.001057
H 0.966828 3.753336 -0.000286
H -3.401560 -3.085566 -0.000465
H 3.401550 -3.085560 -0.000890
H -3.453537 3.722533 0.002054
H 3.453513 3.722541 -0.001409
H -5.380436 -3.086174 -0.001462
H 5.380423 -3.086163 0.000413
H -7.748152 1.331318 0.000578
H 7.748136 1.331332 -0.000426
H -7.869090 -3.009845 -0.002536
H 7.869074 -3.009832 0.001866


