%chk=000060968.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060968

0 1
 O  -0.8144000     -0.4290000     -0.7438000    
 O   -1.902800      -1.860800      0.7003000    
 C    1.622500      5.2000000E-03 -0.7948000    
 C    2.715700     -0.1229000      0.3092000    
 C    1.763600      0.4812000       1.375800    
 C   0.4335000     -0.7940000     -0.1806000    
 C    1.257300       1.515900     -0.7422000    
 C   0.5144000     -0.4306000       1.313800    
 C    1.344400       1.834900      0.7599000    
 C    1.992500     -0.4559000      -2.192000    
 C    3.178100      -1.560800      0.6208000    
 C    4.000700      0.6964000      7.5400002E-02
 C   -1.919400      -1.041300     -0.2080000    
 C   -3.160500     -0.5763000     -0.9396000    
 C   -3.850500      0.6170000     -0.2606000    
 C   -4.251000      0.2865000       1.179500    
 C   -2.924200       1.834500     -0.2731000    
 H    2.178900      0.5750000       2.382000    
 H   0.5738000      -1.871300     -0.3331000    
 H   0.2635000       1.735100      -1.144900    
 H    1.967300       2.129100      -1.308200    
 H   0.6689000      -1.329300       1.920600    
 H  -0.3734000      8.0700003E-02   1.700400    
 H    2.093400       2.610800      0.9500000    
 H   0.3901000       2.198700       1.154700    
 H    2.847200      0.1051000      -2.583700    
 H    2.256200      -1.518300      -2.203900    
 H    1.156100     -0.3130000      -2.884600    
 H    3.820600      -1.568500       1.509200    
 H    2.371400      -2.269800      0.8165000    
 H    3.760500      -1.968300     -0.2133000    
 H    4.623300      0.6937000      0.9776000    
 H    4.592600      0.2628000     -0.7387000    
 H    3.830600       1.743000     -0.1851000    
 H   -2.899200     -0.3374000      -1.977800    
 H   -3.846100      -1.430800     -0.9950000    
 H   -4.755500      0.8580000     -0.8311000    
 H   -3.381700      0.1343000       1.827200    
 H   -4.838200       1.106600       1.607200    
 H   -4.868300     -0.6172000       1.213800    
 H   -2.050400       1.696900      0.3710000    
 H   -2.575000       2.052800      -1.287700    
 H   -3.458600       2.719500      8.9699998E-02


%chk=000060968-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060968

0 1
O -0.746551 -0.085392 -0.695897
O -1.929325 -1.748293 0.434445
C 1.743149 -0.020078 -0.816106
C 2.860138 -0.123581 0.313214
C 2.055327 0.785764 1.315995
C 0.508527 -0.541282 -0.023193
C 1.572351 1.530793 -0.961452
C 0.682842 0.054538 1.411450
C 1.822610 2.083809 0.487069
C 1.989564 -0.753682 -2.137024
C 3.124376 -1.558424 0.838001
C 4.228563 0.460532 -0.111253
C -1.913304 -0.791420 -0.377955
C -3.111816 -0.232011 -1.123347
C -4.094014 0.570701 -0.205013
C -4.809358 -0.337763 0.821316
C -3.388772 1.760324 0.487662
H 2.541465 0.953351 2.292382
H 0.465297 -1.644235 -0.004350
H 0.567020 1.776498 -1.340154
H 2.304755 1.929073 -1.686430
H 0.669785 -0.739878 2.176009
H -0.136376 0.755967 1.649648
H 2.701936 2.751382 0.523318
H 0.960217 2.657331 0.871807
H 2.904735 -0.382238 -2.634146
H 2.099651 -1.844704 -1.987542
H 1.143964 -0.596875 -2.832006
H 3.871128 -1.528925 1.653923
H 2.227951 -2.064662 1.232567
H 3.541968 -2.194289 0.034442
H 4.896984 0.533367 0.767777
H 4.722427 -0.203065 -0.845996
H 4.158244 1.463951 -0.561499
H -2.752374 0.419087 -1.938321
H -3.661465 -1.084359 -1.564582
H -4.862339 0.983336 -0.891868
H -4.083562 -0.816053 1.502092
H -5.521710 0.252050 1.427800
H -5.374530 -1.144314 0.318358
H -2.652760 1.406143 1.234104
H -2.852684 2.395758 -0.241072
H -4.126134 2.389967 1.018625


