%chk=000034312.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034312

0 1
 O    1.096000      -3.062500      -1.012800    
 O   0.7617000       3.076800      -1.044000    
 N  -0.1276000       1.036000     -0.2790000    
 N   -1.482500       2.797700      -1.104500    
 C   -1.554100     -0.9569000     -0.4171000    
 C   -1.279600      0.2999000      0.1333000    
 C  -0.6418000      -1.517900      -1.459800    
 C    1.139700      0.4482000      8.8299997E-02
 C    1.493000     -0.9074000     -0.1105000    
 C   0.6762000      -1.915900     -0.8600000    
 C   -2.684400      -1.667400      8.8999998E-03
 C   -2.148500      0.8401000       1.095700    
 C    2.075900       1.278100      0.7468000    
 C    2.743200      -1.375100      0.3474000    
 C  -0.2072000       2.354700     -0.7916000    
 C   -3.539900      -1.126500      0.9683000    
 C   -3.273000      0.1274000       1.510500    
 C    3.309800      0.7998000       1.189400    
 C    3.642900     -0.5291000      0.9907000    
 H   -1.092900      -2.405900      -1.920000    
 H  -0.4766000     -0.8064000      -2.277300    
 H   -2.908600      -2.646400     -0.4072000    
 H   -1.946800       1.810000       1.544000    
 H    1.840400       2.314800      0.9781000    
 H    3.047700      -2.409300      0.2022000    
 H   -4.414300      -1.683500       1.291700    
 H   -3.937200      0.5487000       2.259300    
 H    3.999000       1.465400       1.700500    
 H    4.599700     -0.9105000       1.334100    
 H   -1.619200       3.726800      -1.489200    
 H   -2.311200       2.217800      -1.047800    


%chk=000034312-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034312

0 1
O 1.033088 -3.082716 -0.981336
O 0.800492 2.977521 -1.197692
N -0.119879 1.035863 -0.197927
N -1.501543 2.681615 -1.213835
C -1.609156 -0.915936 -0.451367
C -1.313649 0.310112 0.196164
C -0.641706 -1.411157 -1.505790
C 1.170038 0.485175 0.146528
C 1.499368 -0.892262 -0.078656
C 0.666730 -1.878286 -0.847804
C -2.754253 -1.642805 -0.049057
C -2.147317 0.808804 1.224471
C 2.117557 1.333618 0.774964
C 2.755044 -1.377407 0.390823
C -0.211552 2.287543 -0.884574
C -3.600471 -1.144102 0.967289
C -3.298377 0.082795 1.604625
C 3.361986 0.833832 1.201101
C 3.681539 -0.535094 1.023086
H -1.051257 -2.262893 -2.071281
H -0.405196 -0.588908 -2.210353
H -2.980078 -2.599179 -0.533596
H -1.883855 1.747081 1.724267
H 1.868570 2.386424 0.920385
H 2.973905 -2.435678 0.215473
H -4.486892 -1.712991 1.267723
H -3.944013 0.463158 2.403361
H 4.075632 1.509223 1.685645
H 4.643017 -0.929674 1.367406
H -1.588812 3.558910 -1.720679
H -2.329162 2.128914 -1.000966


