%chk=000148807.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148807

0 1
 O    1.663600      -1.791000     -0.4370000    
 O    4.293700      -2.649200     -0.7159000    
 O   -5.818100     -0.3286000      3.7999999E-02
 O    1.468800      -1.926300       2.235500    
 N   -3.522000      0.1841000     -0.2031000    
 N    3.758700       1.007600     -0.8847000    
 N   -4.364000      -2.049400      0.1569000    
 C   -3.789600       1.648500     -0.3370000    
 C    4.093500       2.083200      5.4299999E-02
 C    4.194900     -0.2777000     -0.3657000    
 C    3.865600      -1.426300      -1.322200    
 C   -2.452800       2.374300     -0.5228000    
 C   -4.683400       1.871400      -1.561500    
 C   -4.492700       2.155000      0.9279000    
 C    3.605200       3.412400     -0.5313000    
 C    3.388900       1.805000       1.386300    
 C    5.612300       2.124500      0.2601000    
 C   -2.219100     -0.3121000     -0.2562000    
 C    2.377000      -1.537700      -1.643500    
 C   -1.469900     -0.4323000      0.9142000    
 C   0.3864000      -1.303000     -0.3635000    
 C  -0.1672000     -0.9279000      0.8606000    
 C   -1.665400     -0.6872000      -1.480400    
 C   -4.644300     -0.7043000     -1.7500000E-02
 C  -0.3628000      -1.182700      -1.534100    
 C   0.5981000      -1.046100       2.094100    
 C   0.3447000     -8.4399998E-02   3.248600    
 H    4.200200       1.181100      -1.787400    
 H    5.278000     -0.3219000     -0.2095000    
 H    3.733300     -0.5245000      0.5954000    
 H    4.430200      -1.309500      -2.254300    
 H   -2.627500       3.453200     -0.6258000    
 H   -1.923700       2.070500      -1.432400    
 H   -1.783100       2.261700      0.3366000    
 H   -4.781900       2.942700      -1.774100    
 H   -4.257000       1.398100      -2.453700    
 H   -5.699800       1.488000      -1.440900    
 H   -4.577100       3.248100      0.9088000    
 H   -3.927300       1.884100       1.827200    
 H   -5.507900       1.769300       1.050500    
 H    4.089400       3.628800      -1.490900    
 H    2.521800       3.399500     -0.6995000    
 H    3.824300       4.247400      0.1440000    
 H    3.849600       1.002100       1.971200    
 H    2.328000       1.568700       1.241500    
 H    3.427700       2.695800       2.025900    
 H    5.994100       1.302200      0.8740000    
 H    6.151900       2.125700     -0.6944000    
 H    5.896600       3.045100      0.7852000    
 H    2.054400     -0.6171000      -2.144800    
 H    2.215000      -2.390400      -2.313600    
 H   -1.923200     -0.1487000       1.861100    
 H   -2.242900     -0.6052000      -2.397800    
 H   1.3700000E-02  -1.494000      -2.503900    
 H    3.755400      -2.789500      8.1900001E-02
 H   -3.426100      -2.432300      0.1288000    
 H   -5.114500      -2.715000      0.3098000    
 H  -0.4328000     -0.4900000       3.900100    
 H   5.5100001E-02  0.9022000       2.876800    
 H    1.271100      3.9799999E-02   3.817700    


%chk=000148807-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148807

0 1
O 1.563481 -0.137993 -0.298057
O 3.207445 -2.331806 0.000112
O -6.105608 -1.328521 -0.103081
O 1.457592 -1.437193 2.103728
N -4.095623 -0.080838 -0.056895
N 5.088414 0.721441 -1.175707
N -4.094038 -2.429638 -0.429370
C -4.816880 1.242503 0.200584
C 5.626196 2.032405 -0.679848
C 4.534294 -0.235847 -0.190688
C 3.594994 -1.249681 -0.893952
C -3.779950 2.389239 0.286733
C -5.791073 1.538390 -0.971757
C -5.586100 1.155677 1.546590
C 6.246772 2.739880 -1.909332
C 4.459108 2.892738 -0.132942
C 6.712845 1.852388 0.422573
C -2.654306 -0.130730 -0.143009
C 2.354650 -0.557878 -1.487496
C -1.875728 -0.390311 1.007093
C 0.186393 -0.209922 -0.302006
C -0.457796 -0.466187 0.956430
C -1.994637 0.058039 -1.385461
C -4.837468 -1.272309 -0.189686
C -0.589755 0.029769 -1.465496
C 0.310359 -0.897731 2.171336
C -0.345149 -0.729701 3.540250
H 5.790804 0.261414 -1.774438
H 5.301278 -0.826447 0.357400
H 3.946473 0.317012 0.562770
H 4.144342 -1.735614 -1.724429
H -4.327185 3.328651 0.478751
H -3.214248 2.511665 -0.653465
H -3.058388 2.241553 1.109442
H -6.313026 2.495754 -0.788441
H -5.236304 1.624933 -1.924532
H -6.539676 0.736751 -1.064300
H -6.118438 2.106294 1.734885
H -4.885217 0.981477 2.384420
H -6.321316 0.336591 1.516061
H 7.079365 2.143397 -2.331783
H 5.485167 2.877484 -2.697439
H 6.650028 3.729525 -1.629968
H 4.000424 2.444667 0.766894
H 3.673263 2.999373 -0.901549
H 4.824157 3.898497 0.144403
H 6.304177 1.315942 1.298381
H 7.572008 1.272248 0.034621
H 7.090421 2.831842 0.771147
H 2.648187 0.333591 -2.070507
H 1.760527 -1.268929 -2.090523
H -2.400200 -0.568754 1.951117
H -2.595815 0.242999 -2.282216
H -0.089878 0.222959 -2.419703
H 2.610221 -1.967729 0.722291
H -3.081202 -2.443539 -0.519400
H -4.628151 -3.289085 -0.529717
H -1.140273 -1.485821 3.686963
H -0.804043 0.267154 3.659473
H 0.419190 -0.886238 4.316346


