%chk=000015001.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015001

0 1
 O  -0.9229000      -1.151400     -0.6969000    
 O    1.398000     -0.6281000      -1.899200    
 O   0.5202000      -2.104000      0.8192000    
 N   -3.425100     -0.1933000      0.3128000    
 C   -3.303300      -1.409200     -0.4798000    
 C   -1.936900      -2.076400     -0.3052000    
 C    1.260600     -0.2001000     -0.5288000    
 C   -4.427700      0.7033000     -0.2665000    
 C   -3.772300     -0.5125000       1.699300    
 C   0.2797000      -1.272600     -4.8099998E-02
 C   0.6629000       1.208000     -0.4872000    
 C    2.618600     -0.2377000      0.1763000    
 C   -1.770400      -3.329800      -1.155100    
 C   -5.806200      6.4800002E-02 -0.2571000    
 C   -3.835900      0.7430000       2.552300    
 C   0.9394000       2.113700      -1.511500    
 C    2.688300     -0.5187000       1.540800    
 C  -0.1590000       1.586000      0.5748000    
 C    3.786500      8.5000005E-03 -0.5456000    
 C    1.898700      -1.948500      -1.963700    
 C   0.3945000       3.397200      -1.473700    
 C    3.925800     -0.5533000       2.183600    
 C  -0.7039000       2.869500      0.6123000    
 C    5.024000     -2.6100000E-02  9.7199999E-02
 C  -0.4271000       3.775000     -0.4120000    
 C    5.093600     -0.3070000       1.461700    
 H   -4.094900      -2.136100     -0.2566000    
 H   -3.391300      -1.159900      -1.546500    
 H   -1.819400      -2.363700      0.7465000    
 H   -4.447700       1.676700      0.2348000    
 H   -4.147600      0.9400000      -1.301400    
 H   -4.691300      -1.099400       1.807600    
 H   -2.975900      -1.130900       2.130400    
 H   -1.805500      -3.086200      -2.222600    
 H   -2.555600      -4.060200     -0.9372000    
 H  -0.8016000      -3.805200     -0.9706000    
 H   -5.850300     -0.8919000     -0.7849000    
 H   -6.217400     -6.3000001E-02  0.7481000    
 H   -6.501600      0.7313000     -0.7818000    
 H   -2.953900       1.375500       2.411100    
 H   -4.733500       1.338300       2.360700    
 H   -3.866300      0.4634000       3.611500    
 H    1.583100       1.846200      -2.344700    
 H    1.801300     -0.6588000       2.150300    
 H  -0.3794000      0.9028000       1.390300    
 H    3.760600      0.2478000      -1.605100    
 H   0.6117000       4.103200      -2.270000    
 H    3.979500     -0.7585000       3.248700    
 H   -1.340900       3.165900       1.440400    
 H    5.933100      0.1705000     -0.4636000    
 H    2.496600      -2.306800      -1.120600    
 H    1.071100      -2.645500      -2.131100    
 H    2.530100      -2.012900      -2.856500    
 H  -0.8504000       4.774700     -0.3819000    
 H    6.056800     -0.3298000       1.962900    


%chk=000015001-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015001

0 1
O -1.310282 0.134805 -0.933016
O 2.074220 -1.364485 -0.849250
O -0.610232 -2.085527 -1.094696
N -2.737374 -0.959279 1.424543
C -3.374070 -0.121333 0.384803
C -2.751300 -0.273864 -1.018884
C 1.089984 -0.264575 -0.879194
C -2.906825 -0.402888 2.795443
C -3.055113 -2.406959 1.287920
C -0.351548 -0.870282 -0.955649
C 1.323918 0.442800 -2.234404
C 1.296028 0.652457 0.339391
C -3.406149 0.646713 -2.052738
C -4.347930 -0.412515 3.371725
C -2.202764 -3.306987 2.200268
C 1.983117 -0.240624 -3.283986
C 0.462438 0.590284 1.482944
C 0.834592 1.753816 -2.456875
C 2.443818 1.486366 0.368324
C 2.083387 -2.199266 0.360770
C 2.165029 0.387887 -4.537127
C 0.761295 1.368088 2.625577
C 1.016396 2.378723 -3.709291
C 2.741151 2.261509 1.508422
C 1.683861 1.698712 -4.755388
C 1.897346 2.207987 2.643451
H -4.470974 -0.322303 0.275563
H -3.267754 0.938686 0.684385
H -2.770967 -1.325225 -1.358156
H -2.239267 -0.961415 3.477147
H -2.531246 0.638876 2.773234
H -4.141445 -2.608787 1.467178
H -2.842073 -2.692165 0.242739
H -3.335184 1.703899 -1.740614
H -4.474054 0.387534 -2.173350
H -2.910172 0.541874 -3.032050
H -5.042687 0.169248 2.738578
H -4.744028 -1.440185 3.461260
H -4.354903 0.038540 4.381391
H -1.129376 -3.103383 2.037100
H -2.429427 -3.163649 3.272219
H -2.392263 -4.368612 1.959110
H 2.355343 -1.251489 -3.101235
H -0.427888 -0.052371 1.480681
H 0.309707 2.279032 -1.652654
H 3.103345 1.520383 -0.505744
H 2.682413 -0.147900 -5.341170
H 0.107731 1.314039 3.504224
H 0.638497 3.395161 -3.868440
H 3.629223 2.903544 1.514078
H 2.321533 -1.604255 1.263229
H 1.118683 -2.722553 0.490943
H 2.882042 -2.936381 0.182812
H 1.825792 2.185244 -5.727309
H 2.125901 2.810847 3.529868


