%chk=000092449.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092449

0 1
 O   0.6232000       2.049600       1.711500    
 O   -2.352800       1.416900      -1.210800    
 N   -3.168200     -0.2067000      0.2973000    
 N   -2.666800     -0.6642000       1.490800    
 C    4.274900       1.085600     -0.6221000    
 C    5.074100     -0.1763000     -0.2830000    
 C    2.762800      0.9104000     -0.4664000    
 C    6.590300     -8.0899999E-02 -0.4792000    
 C    2.017200       2.199700     -0.8273000    
 C    7.328100      -1.387100     -0.1788000    
 C   0.5007000       2.047900     -0.7087000    
 C    8.822600      -1.259700     -0.4774000    
 C   4.1200001E-02   1.690100      0.6920000    
 C   -1.155000      0.8309000      0.7948000    
 C   -1.463500     -5.6499999E-02   1.752400    
 C   -2.277100      0.7484000     -0.1932000    
 C    9.556100      -2.565600     -0.2162000    
 C   -4.395900     -0.6125000     -0.1850000    
 C  -0.6883000     -0.4443000       2.962100    
 C   -4.915800     -3.4800000E-02  -1.343300    
 C   -5.116800      -1.601000      0.4854000    
 C   -6.156500     -0.4451000      -1.831200    
 C   -6.357400      -2.011400     -2.7999999E-03
 C   -6.877200      -1.433400      -1.161000    
 H    4.499600       1.380300      -1.654700    
 H    4.616000       1.905400      2.2100000E-02
 H    4.871200     -0.4520000      0.7597000    
 H    4.695700      -1.002200     -0.8990000    
 H    2.545200      0.6130000      0.5652000    
 H    2.420800      9.5500000E-02  -1.115700    
 H    6.985200      0.7170000      0.1615000    
 H    6.791400      0.2176000      -1.515600    
 H    2.357100       3.011500     -0.1726000    
 H    2.263600       2.492400      -1.855100    
 H    7.179800      -1.659400      0.8730000    
 H    6.901500      -2.195200     -0.7855000    
 H   1.2900000E-02   2.987000     -0.9923000    
 H   0.1859000       1.270000      -1.412900    
 H    9.259800     -0.4691000      0.1436000    
 H    8.970700     -0.9697000      -1.524200    
 H   -2.831200      -1.607300       1.817600    
 H    9.453900      -2.870000      0.8303000    
 H    9.164100      -3.369000     -0.8480000    
 H    10.62250      -2.451500     -0.4343000    
 H   -1.176800     -6.2199999E-02   3.864200    
 H   0.3389000     -7.2099999E-02   2.945300    
 H  -0.6293000      -1.535200       3.042100    
 H   -4.405200      0.7375000      -1.904900    
 H   -4.759900      -2.079700       1.391600    
 H   -6.562500      4.9000001E-03  -2.732500    
 H   -6.919900      -2.780200      0.5190000    
 H   -7.843300      -1.752600      -1.540700    


%chk=000092449-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092449

0 1
O 0.759067 1.061385 1.910575
O -2.173083 0.648071 -1.455690
N -3.424006 -0.308564 0.348351
N -3.183768 -0.495099 1.721263
C 4.479659 0.967300 -0.515794
C 5.376139 -0.291394 -0.518917
C 2.971089 0.636152 -0.481362
C 6.888404 0.026249 -0.553866
C 2.072209 1.894081 -0.482759
C 7.777529 -1.237731 -0.556212
C 0.567855 1.561879 -0.484076
C 9.291441 -0.926374 -0.593689
C 0.052988 1.017905 0.847857
C -1.306113 0.448053 0.887684
C -1.909142 -0.088359 2.041273
C -2.250163 0.317838 -0.235327
C 10.168272 -2.197613 -0.595487
C -4.704818 -0.563920 -0.214590
C -1.382819 -0.262707 3.431970
C -4.838619 -0.683893 -1.624161
C -5.842832 -0.714648 0.623418
C -6.105198 -0.965504 -2.174427
C -7.099103 -1.011571 0.053000
C -7.239186 -1.141626 -1.346824
H 4.703456 1.579263 -1.415303
H 4.734713 1.597362 0.361783
H 5.150744 -0.900399 0.381538
H 5.115320 -0.923504 -1.393885
H 2.749397 0.037967 0.423734
H 2.716474 0.003080 -1.357887
H 7.150489 0.657421 0.321160
H 7.114589 0.635071 -1.454495
H 2.311434 2.507045 0.407433
H 2.303756 2.506798 -1.377177
H 7.552303 -1.845752 0.345170
H 7.513607 -1.869981 -1.430093
H -0.039202 2.462016 -0.720620
H 0.306429 0.849648 -1.290871
H 9.554864 -0.294908 0.279453
H 9.515877 -0.319232 -1.494562
H -3.760446 -1.153537 2.245755
H 9.982927 -2.806596 0.309612
H 9.945355 -2.830282 -1.475542
H 11.245483 -1.949250 -0.621492
H -1.120078 0.717478 3.864644
H -0.441730 -0.837369 3.415423
H -2.117582 -0.766561 4.086184
H -3.962728 -0.538435 -2.259420
H -5.773670 -0.557081 1.705844
H -6.202438 -1.053435 -3.261972
H -7.971167 -1.124630 0.706330
H -8.216378 -1.367407 -1.785852


