%chk=000154421.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154421

0 1
 O   -4.388600     -0.1142000      2.7000001E-03
 O   -4.704900      -2.715300      9.9999997E-05
 C   0.5310000     -0.6064000     -6.9999998E-04
 C   0.7415000      0.7967000     -7.9999998E-04
 C  -0.8047000      -1.131500     -6.9999998E-04
 C  -0.3813000       1.690700     -7.9999998E-04
 C   -1.916800     -0.2465000      9.9999997E-05
 C   -1.704100       1.170900      3.0000001E-04
 C    1.683100      -1.445500     -9.9999997E-05
 C    2.089100       1.260900     -6.0000003E-04
 C    3.003100     -0.9660000      3.9999999E-04
 C    3.210300      0.4150000      1.9999999E-04
 C   -3.218800     -0.8235000      6.9999998E-04
 C   -1.078600      -2.529500     -1.5000000E-03
 C  -0.2329000       3.107400     -1.8000000E-03
 C   -2.779500       2.104800      1.1000000E-03
 C   -3.444800      -2.198100     -1.9999999E-04
 C   -2.368700      -3.055900     -1.3000000E-03
 C    4.113100      -1.830800      7.9999998E-04
 C    4.525300      0.9160000      6.0000003E-04
 C   -1.311800       3.989200     -6.9999998E-04
 C   -2.592200       3.485200      6.9999998E-04
 C    5.412500      -1.324300      7.9999998E-04
 C    5.618800      5.0600000E-02  5.0000002E-04
 H    1.571900      -2.528000      1.9999999E-04
 H    2.300500       2.328200     -6.0000003E-04
 H  -0.2791000      -3.265300     -2.4000001E-03
 H   0.7471000       3.576400     -3.1000001E-03
 H   -3.824900       1.840800      2.0999999E-03
 H   -2.513100      -4.132300     -2.0000001E-03
 H    3.971900      -2.909700      1.0000000E-03
 H    4.706800       1.988900      3.9999999E-04
 H   -1.141600       5.061300     -1.3000000E-03
 H   -3.446800       4.154800      1.5000000E-03
 H    6.260500      -2.002700      1.0000000E-03
 H    6.628500      0.4503000      5.0000002E-04
 H   -4.996100     -0.5093000     -0.6466000    
 H   -5.329700      -2.039000      0.3105000    


%chk=000154421-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154421

0 1
O -4.442471 -0.203459 -0.517435
O -4.726864 -2.829392 -0.302900
C 0.530174 -0.644368 0.130657
C 0.731578 0.781060 -0.081789
C -0.839985 -1.194833 0.158627
C -0.434843 1.688985 -0.054657
C -1.968489 -0.308206 0.031518
C -1.762203 1.153581 0.075487
C 1.664404 -1.475725 0.231811
C 2.044375 1.267304 -0.238515
C 2.992103 -0.984709 0.100320
C 3.188419 0.427114 -0.159573
C -3.248350 -0.898258 -0.184176
C -1.075565 -2.596568 0.247234
C -0.273211 3.105228 -0.076905
C -2.841041 2.062180 0.323092
C -3.454489 -2.294797 -0.100791
C -2.361334 -3.147446 0.150065
C 4.142576 -1.840398 0.201098
C 4.525585 0.929760 -0.314297
C -1.358604 3.982089 0.075745
C -2.649894 3.454027 0.316970
C 5.428834 -1.323499 0.048996
C 5.622672 0.074890 -0.212512
H 1.545479 -2.549306 0.405568
H 2.219397 2.331939 -0.421810
H -0.237528 -3.285412 0.372578
H 0.725658 3.535814 -0.185668
H -3.818488 1.677140 0.629003
H -2.533540 -4.225050 0.215370
H 3.993709 -2.908774 0.398549
H 4.671863 1.998612 -0.511633
H -1.197034 5.064949 0.053423
H -3.492924 4.122319 0.522675
H 6.300500 -1.982417 0.127403
H 6.639452 0.464991 -0.330652
H -4.246436 0.663951 -0.952686
H -5.347485 -2.079016 -0.509192


