%chk=000174764.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174764

0 1
 O    2.180100      -1.981800      0.3715000    
 O   -3.941600      -3.132100     -0.2695000    
 O    2.116000      0.3423000      9.2399999E-02
 N   -5.576900       1.574800     -0.1513000    
 N   -4.043800     -0.8127000     -0.5427000    
 C   -4.157200       1.533300      0.2281000    
 C   -6.195500      0.2534000      2.8899999E-02
 C   -3.394000      0.5011000     -0.6047000    
 C   -5.478700     -0.7969000     -0.8181000    
 C   -6.288200       2.585700      0.6301000    
 C    4.206100     -0.7954000      0.4881000    
 C    4.530900     -0.7585000       1.986400    
 C    4.550300      0.6683000       2.526100    
 C    5.606100       1.500700       1.805700    
 C    4.915800      0.2725000     -0.3143000    
 C    5.544200       1.369000      0.3054000    
 C   -5.642300       3.949200      0.4045000    
 C   -7.765000       2.608500      0.2464000    
 C   -3.396500      -2.030600     -0.3213000    
 C    2.720200     -0.7033000      0.2911000    
 C    4.931000      0.1787000      -1.716700    
 C    6.186800       2.334600     -0.4856000    
 C   -1.938700      -2.018300     -0.1400000    
 C    5.563600       1.150600      -2.491200    
 C    6.191800       2.228200      -1.875700    
 C   0.7940000      -1.995100      0.1993000    
 C   -1.395800      -1.875300       1.136700    
 C   -1.097600      -2.149500      -1.245000    
 C  -1.1700000E-02  -1.863400       1.308600    
 C   0.2867000      -2.137700      -1.073100    
 H   -4.046800       1.296200       1.294700    
 H   -3.653500       2.486300      4.1900001E-02
 H   -7.236600      0.2373000     -0.3066000    
 H   -6.174900     -4.6500001E-02   1.085000    
 H   -2.357100      0.4556000     -0.2646000    
 H   -3.377400      0.7984000      -1.660600    
 H   -5.599500     -0.5779000      -1.886400    
 H   -5.917600      -1.783500     -0.6365000    
 H   -6.228600       2.361100       1.704200    
 H    4.539600      -1.766500      9.5500000E-02
 H    3.811700      -1.357700       2.557700    
 H    5.518200      -1.209800       2.152100    
 H    3.562000       1.127300       2.401100    
 H    4.762000      0.6591000       3.601400    
 H    6.604400       1.184900       2.133700    
 H    5.480700       2.551200       2.094300    
 H   -5.488700       4.158500     -0.6604000    
 H   -6.284900       4.745800      0.7982000    
 H   -4.686900       4.054900      0.9282000    
 H   -8.315800       1.750800      0.6455000    
 H   -7.904000       2.645500     -0.8401000    
 H   -8.254600       3.496500      0.6636000    
 H    4.446100     -0.6582000      -2.214300    
 H    6.691100       3.177000     -1.8200001E-02
 H    5.567100       1.064500      -3.573800    
 H    6.689500       2.983700      -2.476500    
 H   -2.042300      -1.771400       2.004300    
 H   -1.510300      -2.260800      -2.244400    
 H   0.4112000      -1.752000       2.302100    
 H   0.9415000      -2.239700      -1.932900    


%chk=000174764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174764

0 1
O 2.347108 -1.227738 0.022154
O -3.851170 -2.316284 1.441185
O 3.120418 -1.099361 2.243366
N -6.117274 1.360340 -0.653870
N -4.204304 -0.814137 -0.307505
C -4.654416 1.616274 -0.580987
C -6.440881 0.173625 0.187937
C -3.842127 0.397071 -1.071182
C -5.661034 -1.066171 -0.287750
C -6.936617 2.571439 -0.302244
C 4.716379 -1.011922 0.331073
C 5.817331 -1.696961 1.180283
C 6.282490 -0.808185 2.352811
C 6.894499 0.501760 1.818514
C 5.027085 0.471590 0.037072
C 6.034549 1.176416 0.753669
C -6.606318 3.755052 -1.241738
C -8.449217 2.262111 -0.390054
C -3.376171 -1.522850 0.562066
C 3.348628 -1.112073 1.018017
C 4.289159 1.140411 -0.973657
C 6.268006 2.539514 0.433995
C -1.882070 -1.368772 0.415507
C 4.534288 2.493395 -1.282243
C 5.531838 3.200293 -0.569963
C 0.939662 -1.274889 0.265650
C -1.093366 -1.330181 1.590947
C -1.228251 -1.391185 -0.844833
C 0.315210 -1.268979 1.536550
C 0.176011 -1.350807 -0.921427
H -4.332907 1.868157 0.463729
H -4.396559 2.469545 -1.229558
H -7.515959 -0.052787 0.104279
H -6.210428 0.360230 1.267782
H -2.768421 0.608563 -0.955956
H -4.061418 0.232668 -2.145380
H -5.986016 -1.323598 -1.315039
H -5.846570 -1.918336 0.385532
H -6.707580 2.888050 0.750497
H 4.612075 -1.535396 -0.636714
H 5.447818 -2.669136 1.555083
H 6.679890 -1.907016 0.516886
H 5.419477 -0.592570 3.007010
H 7.032081 -1.349966 2.959460
H 7.890729 0.283471 1.378162
H 7.075497 1.210114 2.649356
H -6.714289 3.441855 -2.296423
H -7.307936 4.586693 -1.051649
H -5.586907 4.151747 -1.095467
H -8.793031 1.566681 0.394566
H -8.690431 1.827051 -1.377373
H -9.025618 3.196793 -0.271570
H 3.512534 0.588232 -1.515779
H 7.043400 3.085353 0.986699
H 3.955199 2.991900 -2.067407
H 5.731016 4.253992 -0.795477
H -1.598692 -1.365352 2.561374
H -1.814845 -1.473012 -1.766296
H 0.909810 -1.227676 2.448830
H 0.694331 -1.384149 -1.884201


