%chk=000003410.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003410

0 1
 O   -2.815100       3.336800      0.9059000    
 O    2.815600      -3.388900      0.5834000    
 O   -2.257600      -2.825700       1.687300    
 O   -3.231500     -0.8373000      -2.928400    
 N   0.5285000       2.387300     -0.3861000    
 N   -2.874000      -2.086900     -0.9507000    
 C    1.877300       2.914400     -0.1591000    
 C    2.901900       2.049600     -0.9159000    
 C  -0.4502000       3.136300      0.3842000    
 C   -1.863700       2.590200      0.1485000    
 C    1.903300       4.376900     -0.6037000    
 C    2.878400      0.5942000     -0.5143000    
 C   -1.971300       1.136900      0.5551000    
 C   -2.371300      0.2002000     -0.3822000    
 C    2.046400     -0.2830000      -1.191100    
 C    3.689900      0.1629000      0.5226000    
 C   -1.666600      0.7753000       1.856000    
 C   -2.469900      -1.139600     -6.8999999E-03
 C   -1.764900     -0.5646000       2.231200    
 C    2.025100      -1.627600     -0.8209000    
 C    3.668800      -1.181900      0.8927000    
 C   -2.166700      -1.522000       1.299800    
 C    2.836300      -2.077200      0.2209000    
 C   -3.210400      -1.876100      -2.283400    
 C    1.941700      -4.250100     -0.1448000    
 H    2.117200       2.862100      0.9111000    
 H    2.737300       2.127700      -1.999800    
 H    3.911000       2.450800     -0.7512000    
 H  -0.2031000       3.130000       1.453000    
 H  -0.4941000       4.191200      9.1499999E-02
 H   0.2971000       2.431300      -1.378400    
 H   -2.129500       2.720700     -0.9079000    
 H    2.940200       4.728100     -0.6655000    
 H    1.459800       4.516000      -1.596400    
 H    1.403800       5.043200      0.1064000    
 H   -2.591200      0.5581000      -1.377600    
 H    1.413900      5.4499999E-02  -2.007400    
 H    4.339600      0.8531000       1.053000    
 H   -1.364800       1.507500       2.598700    
 H   -3.675000       2.887200      0.8390000    
 H   -1.529800     -0.8554000       3.251500    
 H    1.355000      -2.268200      -1.384000    
 H    4.302200      -1.526000       1.705600    
 H   -2.957000      -3.048800     -0.6400000    
 H   -2.238100      -3.407800      0.9129000    
 H   -3.488600      -2.836900      -2.749700    
 H   0.8927000      -3.963000     -1.3300000E-02
 H    2.053100      -5.254800      0.2758000    
 H    2.225600      -4.311900      -1.200900    


%chk=000003410-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003410

0 1
O -2.832239 3.334587 1.289095
O 2.589375 -3.383543 0.573221
O -1.833109 -3.066296 1.339042
O -2.522290 -0.980383 -3.132842
N 0.354984 2.788453 -0.537504
N -2.276857 -2.226379 -1.139971
C 1.796774 3.040909 -0.300412
C 2.651809 2.110044 -1.215426
C -0.583784 3.272056 0.489157
C -1.967648 2.598868 0.337467
C 2.206248 4.527904 -0.493561
C 2.621831 0.648668 -0.799267
C -1.961686 1.104985 0.629783
C -2.145302 0.175987 -0.419119
C 1.598625 -0.227763 -1.230570
C 3.612529 0.128706 0.078025
C -1.761151 0.642527 1.953411
C -2.107195 -1.214246 -0.156961
C -1.719237 -0.741046 2.226893
C 1.547725 -1.574755 -0.804575
C 3.579633 -1.208667 0.517462
C -1.883690 -1.659214 1.174317
C 2.541035 -2.064912 0.076389
C -2.471384 -2.073924 -2.504010
C 1.546115 -4.305189 0.121449
H 1.996588 2.753632 0.751404
H 2.290953 2.228930 -2.257499
H 3.694882 2.481057 -1.196973
H -0.174901 3.014712 1.484083
H -0.756936 4.373908 0.480972
H 0.075283 3.068185 -1.488785
H -2.331367 2.760632 -0.701920
H 3.258701 4.697438 -0.197385
H 2.100910 4.825970 -1.555216
H 1.570552 5.197226 0.114740
H -2.305879 0.510191 -1.446870
H 0.815403 0.148727 -1.896900
H 4.425614 0.781509 0.420905
H -1.634980 1.366307 2.765158
H -3.709563 2.876185 1.331958
H -1.550542 -1.100283 3.250102
H 0.737625 -2.217785 -1.161167
H 4.344084 -1.610455 1.189953
H -2.261619 -3.182205 -0.768258
H -1.694776 -3.311687 2.285233
H -2.582310 -3.061194 -3.008755
H 0.537371 -3.955319 0.419433
H 1.772481 -5.260854 0.618476
H 1.578615 -4.443401 -0.977683


