%chk=000044293.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044293

0 1
 O   -3.837500       1.376600       1.310700    
 O   -3.837100       1.387300      -1.301800    
 N   -2.306600      0.1644000     -3.0000001E-04
 C   8.4899999E-02 -0.2288000     -1.6000000E-03
 C   0.5528000       1.211600      4.9000001E-03
 C    1.191000      -1.108200     -4.8000002E-03
 C    2.058200       1.047100      4.8000002E-03
 C    2.406200     -0.3223000     -8.9999998E-04
 C   -1.215300     -0.7025000     -3.8000001E-03
 C   0.9994000      -2.479700     -1.0100000E-02
 C    3.023700       2.038500      1.0100000E-02
 C    3.735700     -0.7104000     -1.4000000E-03
 C   -1.408100      -2.085100     -9.1000004E-03
 C  -0.3120000      -2.964900     -1.1900000E-02
 C    4.363700       1.647100      9.6000005E-03
 C    4.716200      0.2864000      3.8999999E-03
 C   -2.873800      0.6102000       1.243600    
 C   -2.873400      0.6204000      -1.240800    
 C   -2.245900      8.1400000E-02   2.512500    
 C   -2.222000      0.1309000      -2.513600    
 H   0.2240000       1.726800      0.9119000    
 H   0.2249000       1.735700     -0.8972000    
 H    1.835300      -3.171100     -1.2400000E-02
 H    2.753300       3.088500      1.4600000E-02
 H    4.023300      -1.756400     -5.5000000E-03
 H   -2.413700      -2.499900     -1.0800000E-02
 H  -0.4877000      -4.037500     -1.5799999E-02
 H    5.145300       2.402200      1.3600000E-02
 H    5.766500      6.6000000E-03  3.5999999E-03
 H   -2.336300      -1.006400       2.560000    
 H   -1.197400      0.3801000       2.579500    
 H   -2.771600      0.5024000       3.375400    
 H   -2.274500     -0.9586000      -2.577600    
 H   -2.759000      0.5445000      -3.373100    
 H   -1.184300      0.4666000      -2.570900    


%chk=000044293-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044293

0 1
O -3.858879 1.461066 1.372145
O -3.866825 1.464834 -1.362560
N -2.376550 0.214915 -0.001269
C 0.075235 -0.195357 -0.000537
C 0.561831 1.246124 0.009079
C 1.185766 -1.093754 -0.004711
C 2.078470 1.088065 0.009339
C 2.428193 -0.296966 0.001376
C -1.239450 -0.696291 -0.005417
C 0.980168 -2.491256 -0.013617
C 3.077743 2.076457 0.015933
C 3.782713 -0.696260 0.000182
C -1.447807 -2.098481 -0.014094
C -0.345706 -2.985556 -0.018240
C 4.437460 1.675346 0.014644
C 4.785199 0.300902 0.006890
C -2.913168 0.647167 1.272526
C -2.914191 0.658126 -1.270851
C -2.255514 0.025163 2.504280
C -2.246633 0.059413 -2.508812
H 0.199666 1.803200 0.896016
H 0.200965 1.814717 -0.871005
H 1.827305 -3.185654 -0.016906
H 2.816784 3.140787 0.021950
H 4.059387 -1.756547 -0.005887
H -2.473256 -2.484611 -0.017521
H -0.525046 -4.066046 -0.024977
H 5.228294 2.433522 0.019662
H 5.841690 0.010867 0.006030
H -2.387677 -1.070900 2.523789
H -1.169675 0.220818 2.542411
H -2.737651 0.464506 3.389772
H -2.368561 -1.037392 -2.544515
H -2.729567 0.506927 -3.389771
H -1.162510 0.265647 -2.540035


