%chk=000043265.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043265

0 1
 O   -5.331400       1.981900      0.5751000    
 O   -1.047100      -1.312100     -0.1829000    
 O   7.7500001E-02  -2.786900       1.180700    
 O    1.868000       2.634700     -0.3282000    
 O    4.825700      -1.098100      0.1801000    
 O    4.440000       1.609300     -0.2619000    
 N   -3.612100     -5.5900000E-02 -0.4214000    
 C   -3.346400      -1.418800     -0.8771000    
 C   -4.071400     -5.2900001E-02  0.9745000    
 C   -4.609200      0.5967000      -1.281000    
 C   -2.236800      -2.091900     -6.5499999E-02
 C   -4.354300       1.377900       1.423700    
 C   -4.878300       2.012300     -0.7789000    
 C   -1.913900      -3.500400     -0.5474000    
 C   3.5700001E-02  -1.777900      0.4940000    
 C    1.201600     -0.8811000      0.2924000    
 C    2.471500      -1.420000      0.3306000    
 C   0.9798000      0.4632000      7.5099997E-02
 C    2.075600       1.305700     -0.1123000    
 C    3.567200     -0.5775000      0.1433000    
 C    3.369400      0.7854000     -7.8199998E-02
 C   0.5147000       3.084500     -0.3479000    
 C    5.373600      -1.556500      -1.054300    
 C    4.600800       2.678300      0.6676000    
 H   -3.020900      -1.375800      -1.924900    
 H   -4.257100      -2.030900     -0.8426000    
 H   -3.313700     -0.4417000       1.659800    
 H   -4.980900     -0.6581000       1.081300    
 H   -5.546400      2.4900001E-02  -1.278800    
 H   -4.246000      0.6501000      -2.313600    
 H   -2.522100      -2.173300      0.9886000    
 H   -4.754700       1.377200       2.442600    
 H   -3.443400       1.989300       1.425800    
 H   -3.984700       2.644200     -0.8518000    
 H   -5.663700       2.478800      -1.382100    
 H   -2.833900      -4.023900     -0.8325000    
 H   -1.247400      -3.491500      -1.417000    
 H   -1.456200      -4.126900      0.2225000    
 H    2.630700      -2.481200      0.5006000    
 H  -4.0700000E-02  0.8268000      7.6800004E-02
 H   2.7600000E-02   2.943400      0.6231000    
 H  -5.0799999E-02   2.631800      -1.169700    
 H   0.5375000       4.162900     -0.5362000    
 H    6.381500      -1.934400     -0.8624000    
 H    5.439000     -0.7359000      -1.775700    
 H    4.766900      -2.370100      -1.464300    
 H    5.673000       2.848600      0.8026000    
 H    4.161300       3.594900      0.2644000    
 H    4.166600       2.445000       1.646100    


%chk=000043265-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043265

0 1
O -4.211420 1.001863 2.868375
O -1.294700 -1.383323 -1.238855
O -0.923421 -2.160706 0.939234
O 2.673186 1.574611 -2.389050
O 3.495842 0.091113 2.188797
O 4.287768 1.581378 -0.094526
N -3.504268 -0.211552 0.327755
C -3.679654 -0.861957 -0.982400
C -3.950633 -1.043169 1.474967
C -4.103114 1.145347 0.393184
C -2.658992 -1.991063 -1.244929
C -3.604176 -0.340120 2.796256
C -3.741564 1.809891 1.732344
C -2.845577 -2.644407 -2.616296
C -0.564623 -1.463404 -0.043791
C 0.690718 -0.664234 -0.108698
C 1.546466 -0.676101 1.014653
C 1.035925 0.082729 -1.263652
C 2.231144 0.828431 -1.281791
C 2.737784 0.078434 1.006113
C 3.085436 0.861709 -0.133799
C 1.856773 1.518943 -3.605257
C 4.918537 -0.302016 2.083528
C 4.225714 3.032415 -0.385427
H -3.545697 -0.095721 -1.769888
H -4.706507 -1.294655 -1.113707
H -3.418311 -2.009977 1.452512
H -5.053062 -1.234020 1.429929
H -5.218187 1.113058 0.294356
H -3.702321 1.755071 -0.439305
H -2.687904 -2.746217 -0.438791
H -4.011095 -0.893353 3.658527
H -2.500679 -0.261147 2.888681
H -2.639340 1.939033 1.793759
H -4.238862 2.788713 1.837762
H -3.841834 -3.118628 -2.681800
H -2.761849 -1.896765 -3.425468
H -2.080713 -3.421583 -2.782050
H 1.283173 -1.256815 1.902562
H 0.363705 0.054345 -2.122967
H 0.847085 1.938859 -3.432618
H 1.768379 0.480705 -3.978053
H 2.396202 2.134421 -4.340093
H 5.314738 -0.208205 3.106020
H 5.460433 0.363044 1.391650
H 4.997508 -1.353532 1.745626
H 5.249689 3.397133 -0.213509
H 3.918476 3.206184 -1.428899
H 3.525522 3.529338 0.311732


