%chk=000027541.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027541

0 1
 O    4.040900      0.8334000      0.1139000    
 N  -0.7014000      -1.908600     -6.3699998E-02
 N   -3.920800       1.171600      0.1283000    
 C  -0.9082000      0.2971000     -0.2994000    
 C   -1.604800     -0.8958000     -0.2484000    
 C   -1.527800       1.640700     -0.4948000    
 C   -3.068000      -1.142700     -0.3642000    
 C   0.4787000     -1.7300000E-02 -0.1380000    
 C   -2.698500       1.916600      0.4540000    
 C   -3.886600     -0.2326000      0.5553000    
 C   0.5750000      -1.402700      8.6000003E-03
 C    1.665700      0.7450000     -0.1028000    
 C    1.795600      -2.063300      0.1900000    
 C    2.893800      9.8600000E-02  7.8199998E-02
 C    2.955500      -1.285100      0.2226000    
 C    3.910900       2.245000     -3.9700001E-02
 H  -0.7726000       2.419600     -0.3357000    
 H   -1.855200       1.739700      -1.537700    
 H   -3.379500      -1.007100      -1.407400    
 H   -3.289700      -2.185900     -0.1057000    
 H   -2.410300       1.758800       1.500900    
 H   -2.944200       2.981800      0.3613000    
 H   -4.921300     -0.5965000      0.5315000    
 H   -3.556800     -0.3163000       1.598600    
 H  -0.9361000      -2.889000      9.7000003E-03
 H   -4.697700       1.623900      0.6122000    
 H    1.562000       1.816600     -0.2203000    
 H    1.843900      -3.141400      0.3016000    
 H    3.916600      -1.774200      0.3626000    
 H    3.335300       2.688800      0.7798000    
 H    3.506700       2.508400      -1.023100    
 H    4.918900       2.669600      1.3700000E-02


%chk=000027541-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027541

0 1
O 4.136242 0.811738 0.079231
N -0.711355 -1.963485 -0.039814
N -3.973820 1.142492 0.090987
C -0.943091 0.300393 -0.242684
C -1.638317 -0.916212 -0.195416
C -1.553166 1.672137 -0.423008
C -3.114756 -1.192281 -0.317705
C 0.468559 -0.012940 -0.113641
C -2.790203 1.950573 0.466598
C -3.997289 -0.260746 0.552178
C 0.586557 -1.440275 0.014363
C 1.644902 0.789372 -0.097303
C 1.837475 -2.078823 0.162428
C 2.890425 0.145053 0.048562
C 2.989383 -1.274361 0.178661
C 4.115757 2.264767 -0.059805
H -0.787612 2.439081 -0.191581
H -1.859374 1.831593 -1.477091
H -3.440852 -1.068753 -1.369892
H -3.322728 -2.242899 -0.029085
H -2.500925 1.791595 1.534972
H -3.069676 3.015539 0.351060
H -5.042824 -0.617652 0.485240
H -3.673573 -0.361219 1.617957
H -0.957624 -2.947881 0.036916
H -4.850279 1.627696 0.310345
H 1.571387 1.876362 -0.199341
H 1.922444 -3.166876 0.260320
H 3.986164 -1.711683 0.288671
H 3.552358 2.744162 0.766057
H 3.675571 2.573462 -1.029405
H 5.170237 2.576769 -0.016874


