%chk=000066502.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066502

0 1
 O   -1.915900       1.862200      2.6000000E-03
 O    1.915900      -1.862100      4.1000000E-03
 O   -5.708500      -1.338000     -1.2000001E-03
 O    5.708600       1.338000     -8.9999998E-04
 O   -7.316100      0.6615000     -1.7000000E-03
 O    7.316100     -0.6616000     -1.4000000E-03
 O   -5.558700       2.121900     -2.9000000E-03
 O    5.558700      -2.122000     -3.4000000E-03
 N   -3.795700      4.6900000E-02   0.000000    
 N    3.795700     -4.6999998E-02 -5.0000002E-04
 C   -1.381600     -0.4467000      1.5000000E-03
 C    1.381600      0.4466000      1.1000000E-03
 C  -0.3659000      -1.405100      1.6000000E-03
 C   0.3660000       1.405100      1.7000000E-03
 C   -1.052700      0.9935000      1.8000000E-03
 C    1.052700     -0.9935000      1.8000000E-03
 C   -2.722300     -0.8499000      6.0000003E-04
 C    2.722300      0.8499000       0.000000    
 C  -0.6912000      -2.766800      7.9999998E-04
 C   0.6911000       2.766900      1.3000000E-03
 C   -3.041800      -2.208000     -5.0000002E-04
 C    3.041800       2.208000     -6.9999998E-04
 C   -2.028500      -3.164300     -3.0000001E-04
 C    2.028400       3.164400      9.9999997E-05
 C   -5.154200     -0.2509000     -1.2000001E-03
 C    5.154200      0.2509000     -1.3000000E-03
 C   -6.016700      0.9966000     -1.5000000E-03
 C    6.016700     -0.9966000     -1.6000000E-03
 H   7.8500003E-02  -3.534000      6.9999998E-04
 H  -7.8699999E-02   3.533900      1.5000000E-03
 H   -4.038800      -2.619900     -1.5000000E-03
 H    4.038900       2.619900     -1.8000000E-03
 H   -2.277800      -4.221700     -1.1000000E-03
 H    2.277900       4.221800     -3.9999999E-04
 H   -3.555000       1.033700      3.9999999E-04
 H    3.554800      -1.033700     -3.0000001E-04
 H   -7.902100       1.448100     -2.6000000E-03
 H    7.902100      -1.448300     -2.3000001E-03


%chk=000066502-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066502

0 1
O -2.012173 1.878630 0.000491
O 2.012159 -1.878650 0.000328
O -5.744750 -1.401201 0.002084
O 5.744721 1.401198 0.002182
O -7.340370 0.818656 -0.001307
O 7.340367 -0.818639 -0.001398
O -5.458046 2.186653 -0.002809
O 5.458061 -2.186661 -0.002950
N -3.819988 -0.008452 -0.000400
N 3.819975 0.008430 -0.000399
C -1.408942 -0.462289 -0.000845
C 1.408926 0.462264 -0.000800
C -0.339870 -1.411381 -0.000789
C 0.339853 1.411357 -0.000703
C -1.089703 0.981758 -0.001563
C 1.089686 -0.981782 -0.001616
C -2.768304 -0.944376 -0.000072
C 2.768288 0.944350 0.000009
C -0.605090 -2.797883 0.000125
C 0.605075 2.797859 0.000281
C -3.014864 -2.348713 0.000893
C 3.014849 2.348687 0.001068
C -1.939303 -3.254720 0.000978
C 1.939289 3.254695 0.001182
C -5.183265 -0.272324 0.000355
C 5.183250 0.272315 0.000370
C -5.980179 1.048648 0.000550
C 5.980179 -1.048650 0.000370
H 0.242547 -3.488411 0.000153
H -0.242560 3.488388 0.000329
H -4.048044 -2.699955 0.001484
H 4.048031 2.699928 0.001692
H -2.148428 -4.329199 0.001688
H 2.148412 4.329175 0.001948
H -3.502203 0.993028 -0.001593
H 3.502202 -0.993054 -0.001736
H -7.826009 1.688502 -0.003486
H 7.826019 -1.688479 -0.003592


