%chk=000039523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039523

0 1
 I   -1.839100      -2.119400      0.9523000    
 I   0.6337000       3.460200      0.7570000    
 I    4.138700      -1.462000     -0.1047000    
 O   -1.934800       1.307700       2.211800    
 O    1.507600      -3.546900       1.365600    
 O   -5.763300     -0.8536000     -0.9735000    
 O    3.242500       2.038100      -2.114100    
 O   -4.053500      0.1618000      -2.069300    
 N   -2.348400       1.436900     -6.7100003E-02
 N    3.211300       1.608300      0.2021000    
 N    1.072800      -3.447400     -0.9100000    
 C  -0.2552000      0.5131000      0.7813000    
 C    1.112700      -1.426500      0.4455000    
 C    2.090700      0.7813000      0.3679000    
 C  -0.1382000     -0.8635000      0.6979000    
 C   0.8398000       1.344300      0.6202000    
 C    2.227200     -0.6041000      0.2805000    
 C   -1.587600       1.113000       1.049800    
 C   -3.647600       2.046000      2.9100001E-02
 C   -4.761500       1.009900      0.1033000    
 C    1.256200      -2.880300      0.3518000    
 C    3.700400       2.163000     -0.9828000    
 C   -4.794500      9.1300003E-02  -1.099000    
 C    1.157900      -4.868400      -1.159200    
 C    4.932200       2.997300     -0.7362000    
 H   -3.681400       2.692300      0.9127000    
 H   -3.770400       2.677400     -0.8576000    
 H   -1.978300       1.240000     -0.9926000    
 H   -5.727400       1.522500      0.1653000    
 H   -4.632000      0.3896000      0.9973000    
 H    3.780700       1.717300       1.038600    
 H   0.8363000      -2.842700      -1.691500    
 H    1.531000      -5.019700      -2.174600    
 H   0.1550000      -5.292900      -1.068300    
 H    1.826200      -5.346600     -0.4390000    
 H    4.736500       3.734100      4.8099998E-02
 H    5.211200       3.524900      -1.652500    
 H    5.758400       2.349100     -0.4309000    
 H   -5.788800      -1.455600      -1.747600    


%chk=000039523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039523

0 1
I -1.829561 -2.175206 0.982747
I 0.697100 3.457426 0.895819
I 4.211547 -1.477224 -0.061202
O -1.967306 1.312316 2.399289
O 1.571610 -3.663255 1.517237
O -5.926760 -0.460001 -1.566190
O 2.821869 2.097574 -2.014586
O -3.944538 0.557822 -2.209031
N -2.403636 1.442829 0.109034
N 3.292649 1.616466 0.218222
N 1.184794 -3.565379 -0.786901
C -0.272129 0.509278 0.839558
C 1.152088 -1.490126 0.489366
C 2.153398 0.777481 0.409896
C -0.109802 -0.894642 0.737745
C 0.873121 1.329422 0.684119
C 2.269068 -0.635918 0.326662
C -1.621953 1.121296 1.194991
C -3.747265 2.016954 0.261506
C -4.856441 0.963294 0.056783
C 1.322359 -3.004985 0.465492
C 3.576974 2.228125 -1.013749
C -4.826346 0.368448 -1.337272
C 1.322449 -5.007410 -1.022320
C 4.879806 3.019294 -1.033163
H -3.814679 2.425338 1.283451
H -3.864936 2.843953 -0.460916
H -2.094798 1.215966 -0.840427
H -5.855468 1.402312 0.234738
H -4.738880 0.141531 0.788332
H 3.960751 1.714491 0.986263
H 0.996221 -2.946940 -1.578276
H 2.171145 -5.219554 -1.698091
H 0.397501 -5.427204 -1.457803
H 1.511199 -5.488277 -0.049610
H 5.087671 3.518764 -0.070348
H 4.824733 3.775198 -1.830531
H 5.721479 2.338903 -1.261710
H -5.868033 -0.848560 -2.481523


