%chk=000067187.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067187

0 1
 O    5.519700      -2.916600      5.7999999E-03
 O   -5.735700      -2.747600     -1.7000000E-03
 O   0.7762000       3.807100      -1.099300    
 O   0.7725000       3.809000       1.096000    
 N   0.9733000       3.237900     -7.9999998E-04
 C    1.363700     -0.5111000     -9.9999997E-05
 C   -1.509400     -0.4680000     -5.0000002E-04
 C   0.6632000      0.7188000      3.9999999E-04
 C  -0.7723000      0.7403000      6.0000003E-04
 C   0.6265000      -1.726500     -8.9999998E-04
 C  -0.8090000      -1.704900     -1.7000000E-03
 C    2.806000     -0.5246000      5.0000002E-04
 C   -2.951600     -0.4382000     -3.9999999E-04
 C    3.552200      0.6787000      3.9999999E-04
 C   -3.661300      0.7870000      7.9999998E-04
 C    3.467500      -1.762200      1.3000000E-03
 C   -3.649800      -1.655400     -1.5000000E-03
 C    1.442000       1.893100      8.9999998E-04
 C   -1.515600       1.937500      2.0999999E-03
 C    1.368400      -2.929600     -7.9999998E-04
 C   -1.586600      -2.885300     -3.3000000E-03
 C    2.835800       1.876200      6.9999998E-04
 C    5.038600      0.6507000     -3.9999999E-04
 C   -2.909300       1.962400      2.2000000E-03
 C   -5.147900      0.8035000      8.9999998E-04
 C    2.757200      -2.954900      3.9999999E-04
 C   -2.975600      -2.868800     -3.1999999E-03
 C    4.945800      -1.834400      3.4000000E-03
 C    5.720200     -0.5783000      1.5000000E-03
 C   -5.129600      -1.683200     -8.9999998E-04
 C   -5.866100     -0.4046000      1.9999999E-04
 C    5.838100       1.811300     -3.3000000E-03
 C   -5.912400       1.987600      1.4000000E-03
 C    7.122300     -0.6508000      1.2000001E-03
 C   -7.269700     -0.4349000      5.0000002E-04
 C    7.236400       1.746100     -3.5999999E-03
 C   -7.312000       1.964200      1.5000000E-03
 C    7.878300      0.5153000     -1.3000000E-03
 C   -7.990300      0.7532000      1.1000000E-03
 H   -1.137900       2.938500      3.0000000E-03
 H   0.8828000      -3.901300     -1.3000000E-03
 H   -1.130400      -3.871200     -4.6000001E-03
 H    3.362300       2.828100      8.9999998E-04
 H   -3.378200       2.942400      3.4000000E-03
 H    3.258500      -3.919000      8.9999998E-04
 H   -3.505600      -3.817400     -4.4000000E-03
 H    5.404300       2.806800     -5.4000001E-03
 H   -5.446300       2.968600      1.8000000E-03
 H    7.639400      -1.606500      2.7999999E-03
 H   -7.815200      -1.374800       0.000000    
 H    7.819800       2.662500     -5.7999999E-03
 H   -7.867500       2.897700      2.0000001E-03
 H    8.962800      0.4640000     -1.5000000E-03
 H   -9.075800      0.7344000      1.2000001E-03


%chk=000067187-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000067187

0 1
O 5.573475 -3.029636 0.001388
O -5.801115 -2.864201 -0.002574
O 0.834686 3.921001 -1.144099
O 0.837088 3.923735 1.139765
N 1.006086 3.349020 -0.001673
C 1.382721 -0.467723 0.000242
C -1.536208 -0.435781 0.000101
C 0.672442 0.802407 0.000284
C -0.807017 0.816066 0.000990
C 0.640376 -1.707830 0.000119
C -0.831840 -1.693184 -0.000572
C 2.834486 -0.519379 0.000238
C -2.987921 -0.437010 0.000004
C 3.616470 0.692379 -0.000311
C -3.727951 0.801046 0.001108
C 3.506078 -1.788208 0.000712
C -3.695838 -1.686374 -0.001149
C 1.511322 1.946687 -0.000557
C -1.577786 2.004411 0.002615
C 1.352947 -2.933182 0.000556
C -1.577492 -2.898751 -0.001781
C 2.918728 1.907553 -0.000808
C 5.092411 0.642858 -0.000598
C -2.985761 1.995647 0.002617
C -5.205345 0.792175 0.000813
C 2.754447 -2.976174 0.000950
C -2.980736 -2.897194 -0.002122
C 4.991561 -1.892126 0.001134
C 5.761645 -0.621204 0.000086
C -5.184829 -1.744802 -0.001289
C -5.914693 -0.450493 -0.000397
C 5.895201 1.819833 -0.001625
C -5.972096 1.993088 0.001622
C 7.178432 -0.689811 -0.000184
C -7.332915 -0.475277 -0.000735
C 7.299450 1.743606 -0.001898
C -7.378314 1.960479 0.001280
C 7.950690 0.483006 -0.001153
C -8.068663 0.721017 0.000105
H -1.120775 2.988335 0.004263
H 0.812936 -3.881440 0.000674
H -1.068135 -3.864129 -0.002533
H 3.451094 2.861325 -0.001408
H -3.492952 2.963540 0.003873
H 3.296970 -3.926508 0.001430
H -3.552188 -3.830447 -0.003050
H 5.431648 2.810607 -0.002283
H -5.475302 2.967242 0.002485
H 7.638361 -1.682871 0.000412
H -7.823828 -1.453452 -0.001664
H 7.890985 2.665454 -0.002711
H -7.941131 2.900243 0.001912
H 9.044032 0.427681 -0.001349
H -9.163238 0.699546 -0.000153


