%chk=000075589.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075589

0 1
 O  -0.5982000       2.316700      8.0499999E-02
 O  -0.7551000      -2.367500     -0.3028000    
 N  -0.7963000     -2.1299999E-02 -0.1120000    
 N    5.593100       1.026000     -1.3300000E-02
 C    2.023300     -0.1206000     -5.3199999E-02
 C    1.386500       1.124300     -8.0399998E-02
 C    1.299900      -1.317600     -5.4699998E-02
 C    3.440600     -0.1705000     -2.3499999E-02
 C  -9.1100000E-02   1.204000     -5.3700000E-02
 C  -0.1772000      -1.293100     -0.1438000    
 C   -2.243700      2.9400000E-02 -0.1419000    
 C    4.176900       1.023100     -3.7400000E-02
 C    2.137500       2.308100     -9.4999999E-02
 C    1.964500      -2.551200     -1.0700000E-02
 C   -2.974000      1.1400000E-02   1.039800    
 C    4.089900      -1.412900      1.9200001E-02
 C    3.528200       2.254400     -7.6800004E-02
 C    3.355000      -2.595400      2.9200001E-02
 C   -2.884900      9.6199997E-02  -1.373000    
 C   -4.367100      6.0899999E-02  0.9900000    
 C   -5.019100      0.1283000     -0.2414000    
 C   -4.278000      0.1460000      -1.422900    
 C   -2.302200     -6.0199998E-02   2.372600    
 C   -6.508500      0.1815000     -0.2950000    
 H    1.657700       3.283000     -0.1168000    
 H    1.417000      -3.490000     -1.0600000E-02
 H    5.170100      -1.514100      4.6900000E-02
 H    4.093600       3.182900     -8.8000000E-02
 H    3.866700      -3.553000      6.2600002E-02
 H   -2.315900      0.1109000      -2.298700    
 H   -4.949900      4.9400002E-02   1.908100    
 H   -4.773800      0.2001000      -2.388400    
 H   -1.705000     -0.9741000       2.454200    
 H   -1.656000      0.8101000       2.525500    
 H   -3.027100     -7.3399998E-02   3.193800    
 H    6.136300      0.1771000      1.4700000E-02
 H    6.082500       1.911900     -2.3000000E-02
 H   -6.952400     -0.3971000      0.5223000    
 H   -6.850300       1.218500     -0.2184000    
 H   -6.887700     -0.2435000      -1.230500    


%chk=000075589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075589

0 1
O -0.724604 2.299780 -0.002521
O -0.866854 -2.378186 -0.070761
N -0.783769 -0.039933 -0.085287
N 5.650827 1.068115 -0.017540
C 2.075023 -0.125606 -0.049288
C 1.395270 1.133321 -0.031601
C 1.323474 -1.345848 -0.068387
C 3.518746 -0.183598 -0.043047
C -0.079686 1.210496 -0.037255
C -0.168033 -1.322520 -0.074314
C -2.244559 0.010162 -0.128945
C 4.265187 1.064770 -0.021359
C 2.150013 2.321702 -0.007398
C 1.976630 -2.587721 -0.081163
C -2.989389 0.035984 1.076820
C 4.149928 -1.466042 -0.057310
C 3.558845 2.293292 -0.003131
C 3.395224 -2.647484 -0.076150
C -2.883744 0.028446 -1.382323
C -4.399915 0.082382 0.975654
C -5.070791 0.106717 -0.273326
C -4.290996 0.074793 -1.456128
C -2.297238 0.011536 2.424640
C -6.586306 0.190165 -0.339496
H 1.609104 3.273666 0.006860
H 1.364738 -3.495370 -0.095075
H 5.242956 -1.553450 -0.052421
H 4.121108 3.234173 0.013817
H 3.899788 -3.618731 -0.086748
H -2.277157 0.002958 -2.293785
H -4.992486 0.099871 1.899422
H -4.785043 0.085883 -2.434717
H -1.680714 -0.899188 2.540398
H -1.627790 0.883665 2.543033
H -3.031607 0.031899 3.247445
H 6.194202 0.211221 -0.034235
H 6.157118 1.949579 -0.000854
H -7.059592 -0.336450 0.508178
H -6.927173 1.243362 -0.303244
H -6.974935 -0.249110 -1.274956


