%chk=000048294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048294

1 1
 O   0.2701000       1.637500      0.7801000    
 O   0.3419000       2.586100      -1.329300    
 N   9.2500001E-02  -1.789100      0.7068000    
 N    2.254000       2.634400     -5.9000002E-03
 C  -0.2653000     -0.8550000     -0.3918000    
 C    1.229500      -2.724900      0.2761000    
 C   0.5543000      -1.015700       1.949000    
 C   -1.113700      -2.651500       1.101100    
 C   -1.374300      8.5900001E-02 -2.6000001E-02
 C    2.494700      -1.994500     -6.5399997E-02
 C   -2.718900     -0.2470000     -0.2578000    
 C   -1.033100       1.308400      0.5536000    
 C   -3.731700      0.6729000      0.1038000    
 C    2.713400      -1.569300      -1.371100    
 C    3.437300      -1.748500      0.9269000    
 C   -2.029200       2.212900      0.9096000    
 C   -3.080600      -1.472600     -0.8403000    
 C   -3.370200       1.898600      0.6867000    
 C   -5.076300      0.3401000     -0.1276000    
 C    3.889500     -0.8899000      -1.688700    
 C    4.613300      -1.069100      0.6093000    
 C   -4.421500      -1.786700      -1.063200    
 C   -5.417500     -0.8820000     -0.7076000    
 C    4.839400     -0.6398000     -0.6986000    
 C   0.9190000       2.314400     -0.2769000    
 C    3.055200       3.333800      -1.000100    
 C    2.928200       2.310700       1.247300    
 H  -0.4820000      -1.437300      -1.294000    
 H   0.6193000     -0.2729000     -0.6565000    
 H   0.8677000      -3.303200     -0.5840000    
 H    1.402500      -3.438300       1.092400    
 H    1.337700     -0.3098000       1.681500    
 H  -0.3033000     -0.5102000       2.400900    
 H   0.9338000      -1.741300       2.676600    
 H  -0.7799000      -3.321400       1.902600    
 H   -1.913000      -2.032600       1.510300    
 H   -1.405000      -3.272200      0.2529000    
 H    1.987500      -1.765600      -2.155400    
 H    3.282900      -2.087200       1.947400    
 H   -1.770600       3.166400       1.362300    
 H   -2.365000      -2.194600      -1.212800    
 H   -4.132100       2.620600      0.9729000    
 H   -5.871400       1.032400      0.1417000    
 H    4.066000     -0.5564000      -2.707100    
 H    5.353800     -0.8755000       1.379800    
 H   -4.687800      -2.730600      -1.530100    
 H   -6.461000      -1.125400     -0.8851000    
 H    5.754700     -0.1100000     -0.9455000    
 H    3.399000       4.280200     -0.5728000    
 H    2.482800       3.540200      -1.908000    
 H    3.918000       2.712700      -1.257500    
 H    2.284300       1.769100       1.940600    
 H    3.239200       3.246500       1.721400    
 H    3.813000       1.710100       1.028800    


%chk=000048294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048294

1 1
O 0.334049 1.626780 0.759793
O 0.862683 1.677114 -1.549405
N 0.142180 -1.969428 0.684709
N 2.166446 2.850070 0.021361
C -0.330437 -0.954767 -0.419556
C 1.312573 -2.840025 0.088020
C 0.607578 -1.237925 1.935338
C -0.981040 -2.923453 1.070827
C -1.401796 0.022101 0.005591
C 2.611450 -2.110570 -0.169402
C -2.815730 -0.243114 -0.202260
C -1.032704 1.276754 0.527278
C -3.791350 0.751824 0.208498
C 2.863489 -1.488668 -1.421316
C 3.632921 -2.107434 0.818685
C -1.987117 2.254002 0.926032
C -3.312174 -1.437076 -0.828921
C -3.345007 1.985992 0.781320
C -5.190113 0.503769 0.016800
C 4.100099 -0.854854 -1.669583
C 4.870505 -1.476439 0.570394
C -4.681106 -1.646234 -1.016508
C -5.634253 -0.675470 -0.580491
C 5.104602 -0.845353 -0.674183
C 1.127296 2.060503 -0.381720
C 3.145866 3.297327 -0.990924
C 2.389629 3.315163 1.403305
H -0.659555 -1.586335 -1.260884
H 0.573539 -0.416411 -0.733528
H 0.894740 -3.267903 -0.839803
H 1.451643 -3.654273 0.820187
H 1.370876 -0.498510 1.664463
H -0.255621 -0.724618 2.382636
H 1.017018 -1.978375 2.640477
H -0.637953 -3.557685 1.903409
H -1.862183 -2.343440 1.378457
H -1.237396 -3.555049 0.206719
H 2.105050 -1.510560 -2.212846
H 3.471594 -2.619509 1.775741
H -1.628319 3.201726 1.336890
H -2.617956 -2.196729 -1.201552
H -4.088625 2.729137 1.088986
H -5.907599 1.266953 0.338211
H 4.283801 -0.385947 -2.641436
H 5.654604 -1.492446 1.334194
H -5.029441 -2.558424 -1.512094
H -6.703170 -0.855108 -0.730220
H 6.070472 -0.369485 -0.873798
H 3.172506 4.401365 -1.028191
H 2.851374 2.911194 -1.977191
H 4.154967 2.924748 -0.734842
H 1.556788 3.006763 2.047257
H 2.469872 4.417636 1.415283
H 3.331539 2.894495 1.803090


