%chk=000034500.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034500

0 1
 I    1.506800       2.343400      -1.305300    
 I   -1.408300      -2.301200       1.419800    
 I    4.337000      -2.919900     -2.2399999E-02
 O   -2.097200       2.233200       1.278600    
 O    5.932300       1.317400     -0.6842000    
 O    4.502300       1.040600       1.057300    
 N  -0.8545000      0.6250000      7.9999998E-02
 C   -1.702100      0.5926000      -1.113000    
 C   0.3585000     -0.1732000      4.4300001E-02
 C    2.647000     -0.3986000     -0.5384000    
 C    1.486400      0.3746000     -0.5078000    
 C   -3.102100      0.1810000     -0.8040000    
 C   0.3068000      -1.438500      0.5684000    
 C   -1.140700       1.460000       1.183100    
 C    3.910600      0.1505000      -1.130900    
 C    2.637400      -1.691900     -1.5600000E-02
 C    1.467400      -2.211700      0.5379000    
 C   -3.457100      -1.167400     -0.8414000    
 C   -4.056600       1.144600     -0.4779000    
 C  -0.1997000       1.351800       2.361100    
 C   -4.766400      -1.552200     -0.5527000    
 C   -5.365800      0.7598000     -0.1889000    
 C    4.778900      0.8690000     -0.1219000    
 C   -5.720800     -0.5887000     -0.2263000    
 H   -1.268500     -6.6500001E-02  -1.876000    
 H   -1.712200       1.602800      -1.540700    
 H    3.720300      0.8238000      -1.970500    
 H    4.511500     -0.6304000      -1.605400    
 H    1.460100      -3.220500      0.9458000    
 H   -2.753600      -1.919300      -1.186900    
 H   -3.813200       2.203100     -0.4815000    
 H   0.8311000       1.563900       2.069600    
 H  -0.2663000      0.3699000       2.831200    
 H  -0.4831000       2.097500       3.111700    
 H   -5.048600      -2.599700     -0.6045000    
 H   -6.111500       1.510800      5.5100001E-02
 H   -6.742000     -0.8877000     -8.7000001E-03
 H    6.498200       1.784700     -3.3300001E-02


%chk=000034500-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034500

0 1
I 1.601626 2.351542 -1.244587
I -1.681969 -1.651679 2.129601
I 3.736363 -3.360083 0.076007
O -1.962652 2.857762 1.453982
O 5.851630 0.752782 -1.241735
O 4.663118 0.758604 0.756112
N -0.885950 1.099390 0.382598
C -1.798164 1.246148 -0.802405
C 0.159765 0.122119 0.325320
C 2.420453 -0.568041 -0.529227
C 1.366265 0.379422 -0.396333
C -3.026892 0.347566 -0.778117
C 0.043325 -1.144186 0.965579
C -1.024009 2.008049 1.452698
C 3.683688 -0.257354 -1.299289
C 2.230763 -1.814861 0.128686
C 1.070723 -2.105026 0.873199
C -3.075199 -0.828641 -1.566327
C -4.147701 0.688897 0.022749
C 0.005884 1.920569 2.570658
C -4.215295 -1.663700 -1.544919
C -5.286804 -0.144613 0.046205
C 4.732774 0.460102 -0.451810
C -5.323362 -1.324612 -0.735225
H -1.196370 1.046586 -1.706638
H -2.101458 2.307598 -0.807539
H 3.479477 0.378446 -2.178809
H 4.153891 -1.179465 -1.685479
H 0.963774 -3.067826 1.375669
H -2.217153 -1.094166 -2.197629
H -4.108387 1.601226 0.628851
H 1.039624 1.962503 2.184541
H -0.105131 0.980202 3.140158
H -0.163011 2.766924 3.252166
H -4.240833 -2.572050 -2.157562
H -6.147320 0.126298 0.668590
H -6.209250 -1.969736 -0.717533
H 6.536067 1.215906 -0.686504


