%chk=000140948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140948

0 1
 O   -3.840400      0.1777000     -0.4311000    
 C    2.630200     -0.3065000     -0.3789000    
 C    1.659100      0.3134000      0.6440000    
 C    2.502600      0.3971000      -1.746800    
 C    4.089700     -0.1815000      0.1085000    
 C    2.363400      -1.812200     -0.6198000    
 C   0.2068000      0.2777000      0.3599000    
 C    2.006500      0.9018000       1.802700    
 C  -0.3680000       1.325400     -0.3345000    
 C  -0.5365000     -0.8024000      0.7971000    
 C   -1.736600       1.291700     -0.6015000    
 C   -1.905100     -0.8361000      0.5300000    
 C   -2.505200      0.2109000     -0.1692000    
 C   -4.566400     -0.9568000      3.9600000E-02
 H    3.260300      3.0400001E-02  -2.449600    
 H    1.526400      0.2232000      -2.212400    
 H    2.644800       1.479700      -1.649600    
 H    4.783600     -0.6185000     -0.6202000    
 H    4.251000     -0.7093000       1.055700    
 H    4.387900      0.8659000      0.2348000    
 H    2.400000      -2.372900      0.3215000    
 H    3.111500      -2.245700      -1.293800    
 H    1.382100      -1.985200      -1.075000    
 H    3.034100      0.9957000       2.132400    
 H    1.261300       1.318300       2.475700    
 H   0.2177000       2.175500     -0.6733000    
 H  -8.0899999E-02  -1.622800       1.345200    
 H   -2.198600       2.110600      -1.146200    
 H   -2.442300      -1.705000      0.8948000    
 H   -4.220800      -1.881200     -0.4355000    
 H   -5.611500     -0.8171000     -0.2558000    
 H   -4.549000      -1.020300       1.132900    


%chk=000140948-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000140948

0 1
O -3.927085 0.195327 -0.461990
C 2.714889 -0.292121 -0.371672
C 1.727942 0.310216 0.660988
C 2.532452 0.423775 -1.744406
C 4.190664 -0.136517 0.073458
C 2.409547 -1.809400 -0.556565
C 0.250823 0.236761 0.355250
C 2.121945 0.898387 1.823440
C -0.406330 1.286809 -0.345944
C -0.537513 -0.854141 0.797566
C -1.789361 1.244981 -0.600557
C -1.929001 -0.915901 0.550163
C -2.556248 0.139325 -0.155979
C -4.762783 -0.920980 -0.016830
H 3.227106 -0.009130 -2.488727
H 1.504114 0.306361 -2.128287
H 2.749334 1.504857 -1.659847
H 4.856871 -0.580189 -0.689487
H 4.383849 -0.653250 1.031554
H 4.471127 0.926613 0.188954
H 2.540429 -2.358683 0.394425
H 3.101066 -2.243860 -1.302968
H 1.377126 -1.973387 -0.911409
H 3.174104 0.988380 2.111063
H 1.384341 1.309746 2.522219
H 0.175661 2.151534 -0.683451
H -0.059111 -1.666426 1.356375
H -2.296337 2.055133 -1.133684
H -2.501524 -1.774782 0.913569
H -4.437463 -1.876500 -0.473287
H -5.778554 -0.674208 -0.359067
H -4.754382 -1.017232 1.086733


