%chk=000128361.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128361

0 1
 O   -4.803100      -1.544700     -0.2879000    
 O   -5.778700      0.4384000      0.3844000    
 O    6.229400     -0.9774000     -0.2962000    
 N    4.406700      0.4576000     -5.2999998E-03
 C   -1.366700       1.101200     -0.4408000    
 C   -2.316000     -1.2900000E-02  4.9899999E-02
 C   4.6500001E-02  0.9809000      0.1408000    
 C   0.6523000     -0.3938000     -0.2956000    
 C    2.129200     -0.5682000      0.2176000    
 C   -1.746800      -1.355600     -0.4262000    
 C   -3.612300      0.4319000     -0.6630000    
 C  -0.3027000      -1.567400      6.5099999E-02
 C   -2.166000       2.377100     -0.1982000    
 C   0.9348000       2.147500     -0.3043000    
 C    2.967900      0.6502000     -0.2879000    
 C   -3.614400       1.968800     -0.5231000    
 C    2.375700       1.990400      0.1727000    
 C   -2.510500     -4.2500000E-02   1.588700    
 C    2.183800     -0.7035000       1.757900    
 C    2.789500      -1.807700     -0.3624000    
 C   -4.861400     -0.1925000     -0.1229000    
 C    4.098600      -1.883400     -0.6321000    
 C    5.018000     -0.7633000     -0.3013000    
 C    5.186200       1.540800      0.5815000    
 C   -5.940100      -2.271800      0.1883000    
 H   -1.263700       1.012000      -1.535600    
 H  -1.4200000E-02   1.024300       1.233100    
 H   0.7021000     -0.3825000      -1.396400    
 H   -1.753700      -1.401800      -1.522800    
 H   -2.361300      -2.192500     -7.6200001E-02
 H   -3.568200      0.1933000      -1.735000    
 H  -0.3144000      -1.729200       1.147400    
 H   5.7799999E-02  -2.500400     -0.3798000    
 H   -1.833200       3.200500     -0.8383000    
 H   -2.083800       2.711200      0.8420000    
 H   0.5378000       3.093200      8.2900003E-02
 H   0.9251000       2.226600      -1.399100    
 H    2.920300      0.6560000      -1.388900    
 H   -4.282700       2.343200      0.2595000    
 H   -3.938400       2.427500      -1.464700    
 H    2.956900       2.825100     -0.2360000    
 H    2.417800       2.085300       1.263700    
 H   -2.983200      0.8694000       1.967300    
 H   -3.149700     -0.8821000       1.884800    
 H   -1.570600     -0.1622000       2.133300    
 H    1.692700      0.1279000       2.270200    
 H    1.704000      -1.627800       2.098700    
 H    3.215600     -0.7363000       2.127400    
 H    2.189600      -2.692400     -0.5482000    
 H    4.536800      -2.796600      -1.018900    
 H    6.219600       1.229500      0.7577000    
 H    4.746100       1.825700       1.540600    
 H    5.193300       2.390400     -0.1063000    
 H   -5.768400      -3.334300     -3.1999999E-03
 H   -6.841300      -1.959100     -0.3475000    
 H   -6.059200      -2.123900       1.265800    


%chk=000128361-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128361

0 1
O -5.079563 -1.511097 -0.697648
O -5.675825 0.186353 0.777543
O 6.315434 -0.936753 -0.249361
N 4.445382 0.462632 0.014886
C -1.357481 1.094499 -0.356720
C -2.310942 -0.041833 0.136798
C 0.067473 0.986933 0.222417
C 0.671052 -0.397356 -0.195245
C 2.157272 -0.566270 0.296746
C -1.715616 -1.397350 -0.310808
C -3.629096 0.401710 -0.611026
C -0.265873 -1.568404 0.219311
C -2.177278 2.390341 -0.147686
C 0.968492 2.151267 -0.250776
C 2.987960 0.639243 -0.269558
C -3.649878 1.960381 -0.470489
C 2.433463 1.994224 0.213331
C -2.542812 -0.021660 1.671760
C 2.255696 -0.662236 1.850418
C 2.790901 -1.831353 -0.277403
C -4.889155 -0.260381 -0.090013
C 4.121702 -1.898254 -0.546075
C 5.050550 -0.766996 -0.265123
C 5.324035 1.626215 0.224681
C -6.267494 -2.270777 -0.237602
H -1.258467 0.949957 -1.458538
H 0.006490 1.035449 1.329709
H 0.709772 -0.394218 -1.310415
H -1.706532 -1.440727 -1.420022
H -2.344402 -2.240206 0.034465
H -3.514745 0.105883 -1.671254
H -0.286522 -1.660120 1.321856
H 0.129536 -2.527875 -0.163938
H -1.835969 3.213010 -0.800271
H -2.088957 2.745628 0.896734
H 0.564596 3.112417 0.120009
H 0.941644 2.201528 -1.360530
H 2.852638 0.609191 -1.378451
H -4.347791 2.255091 0.331987
H -4.012376 2.425667 -1.404173
H 3.036844 2.823345 -0.198963
H 2.495726 2.066448 1.316325
H -3.045728 0.902497 2.003848
H -3.187656 -0.867970 1.972400
H -1.598162 -0.113241 2.233509
H 1.696525 0.144516 2.355998
H 1.855079 -1.626365 2.209190
H 3.311938 -0.600734 2.165283
H 2.161298 -2.719803 -0.411740
H 4.605589 -2.810316 -0.909653
H 6.343223 1.236605 0.376911
H 5.014943 2.205485 1.111428
H 5.337252 2.299492 -0.655737
H -6.246872 -3.203609 -0.818305
H -7.188118 -1.697063 -0.437626
H -6.199791 -2.472944 0.844810


