%chk=000038482.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038482

0 1
 O   -1.116400      -1.552800     -0.9613000    
 O   -1.127800      -2.073500       1.286400    
 N   -4.312100      0.2488000     -0.5823000    
 C    1.721100      -1.026600      0.9049000    
 C    3.237400      -1.278600      0.9360000    
 C    3.960600      -1.286200     -0.4062000    
 C    1.342900      0.4181000      0.6253000    
 C    4.008000      7.2800003E-02  -1.093300    
 C    2.649500      0.5603000      -1.584200    
 C    1.772800       1.144200     -0.5034000    
 C   0.9480000      -2.009600      2.1900000E-02
 C   0.4961000       1.056600       1.556600    
 C    1.345400       2.478600     -0.6607000    
 C  -0.5392000      -1.893000      0.2293000    
 C   8.8000000E-02   2.378500       1.385700    
 C   0.5143000       3.091200      0.2753000    
 C   -2.539500      -1.402000     -0.9354000    
 C   -2.871500      4.3900002E-02 -0.6027000    
 C   -4.632300       1.650800     -0.3032000    
 C   -4.945500     -0.6216000      0.4114000    
 H    1.403800      -1.235700       1.938300    
 H    3.404900      -2.259900       1.400500    
 H    3.717100     -0.5464000       1.599000    
 H    3.525400      -2.035700      -1.076800    
 H    4.994900      -1.607600     -0.2277000    
 H    4.667800     -2.3800001E-02  -1.965200    
 H    4.471400      0.8160000     -0.4327000    
 H    2.108900     -0.2298000      -2.115500    
 H    2.841100       1.331100      -2.342800    
 H    1.223200      -3.043500      0.2638000    
 H    1.178500      -1.877600      -1.039100    
 H   0.1421000      0.5208000       2.435100    
 H    1.660000       3.057300      -1.526800    
 H  -0.5635000       2.845700       2.118000    
 H   0.1991000       4.120300      0.1324000    
 H   -2.905200      -1.654900      -1.937200    
 H   -2.967600      -2.136600     -0.2470000    
 H   -2.413000      0.3239000      0.3547000    
 H   -2.404700      0.6888000      -1.358800    
 H   -5.714500       1.816200     -0.3489000    
 H   -4.274500       1.967700      0.6832000    
 H   -4.184100       2.305100      -1.059400    
 H   -4.965100      -1.666200      8.6900003E-02
 H   -4.465000     -0.5547000       1.394400    
 H   -6.000500     -0.3492000      0.5392000    


%chk=000038482-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038482

0 1
O -1.259957 -1.659179 -1.092094
O -1.062995 -1.950957 1.215484
N -4.610858 -0.000934 -0.495383
C 1.769652 -1.048149 0.841714
C 3.275094 -1.442543 0.859025
C 4.048950 -1.353413 -0.475780
C 1.495030 0.456510 0.713255
C 4.205221 0.074866 -1.044121
C 2.872674 0.741116 -1.479943
C 1.997367 1.273629 -0.348423
C 0.962064 -1.885338 -0.199216
C 0.677380 1.056720 1.706799
C 1.667922 2.654392 -0.357134
C -0.529902 -1.836231 0.085800
C 0.354318 2.431073 1.681783
C 0.857620 3.239736 0.640524
C -2.744018 -1.559295 -0.946400
C -3.147283 -0.092835 -0.698695
C -5.191869 1.274610 -0.958647
C -5.024998 -0.328380 0.885566
H 1.368871 -1.352391 1.828485
H 3.338179 -2.488220 1.225708
H 3.786496 -0.813414 1.614792
H 3.559326 -1.993550 -1.238514
H 5.057340 -1.786185 -0.317979
H 4.871448 0.027204 -1.928900
H 4.711112 0.720983 -0.299140
H 2.307288 0.012457 -2.097249
H 3.108582 1.585598 -2.154985
H 1.281478 -2.944815 -0.121601
H 1.138129 -1.563167 -1.236561
H 0.280925 0.424235 2.510181
H 2.058684 3.282035 -1.168117
H -0.278098 2.861390 2.466388
H 0.624800 4.309977 0.603036
H -3.147682 -1.923446 -1.902617
H -3.065608 -2.212676 -0.117541
H -2.566799 0.310300 0.165387
H -2.869724 0.504084 -1.585838
H -6.293471 1.227150 -0.881476
H -4.846307 2.162790 -0.371309
H -4.932844 1.441856 -2.018996
H -4.603441 -1.299693 1.194847
H -4.693647 0.437625 1.631282
H -6.126149 -0.404327 0.934303


