%chk=000025900.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025900

0 1
 O    2.585200      -1.160100     -0.5594000    
 O    2.632400      0.9484000      0.3420000    
 N   -3.647400      -2.846400     -0.4193000    
 C   0.6944000     -0.4976000      0.7988000    
 C    1.008900      -1.257200       2.155500    
 C  -0.1245000      -1.403900     -0.1915000    
 C  -0.1281000      0.8119000      0.9696000    
 C   -1.563800      -1.732200      0.2404000    
 C    2.068800     -0.1280000      0.1677000    
 C    1.793700     -0.4103000       3.176600    
 C    1.762800      -2.587700       1.980000    
 C  -0.4395000       1.575400     -0.1302000    
 C   -2.287700      -2.533900     -0.8433000    
 C  -0.4892000       1.108300       2.257000    
 C   -1.189900       2.754400      9.2000000E-02
 C   -1.227400       2.267700       2.475400    
 C  -5.3500000E-02   1.243300      -1.439100    
 C   -1.576200       3.086500       1.400900    
 C    3.872600     -0.9315000      -1.141300    
 C   -1.532200       3.566800      -1.001200    
 C  -0.4021000       2.062300      -2.513400    
 C   -4.393600      -1.619500     -0.1349000    
 C   -4.337600      -3.634900      -1.441700    
 C   -1.140100       3.222000      -2.294900    
 C    3.799100      0.2783000      -2.060500    
 C    4.315000      -2.182300      -1.885200    
 H   5.0999999E-02  -1.526000       2.620900    
 H   0.3950000      -2.366300     -0.2824000    
 H  -0.1522000      -1.101600      -1.233500    
 H   -2.084400     -0.7907000      0.4242000    
 H   -1.554500      -2.299300       1.178200    
 H    1.434300     -0.6116000       4.192400    
 H    2.856400     -0.6848000       3.167900    
 H    1.789200      0.6689000       3.011800    
 H    1.905200      -3.063000       2.958400    
 H    2.757500      -2.456100       1.546300    
 H    1.204800      -3.304900       1.373800    
 H   -2.287600      -1.972500      -1.787100    
 H   -1.734100      -3.464900      -1.018400    
 H  -0.3656000      0.4908000       3.131800    
 H   -1.554400       2.524800       3.479000    
 H   0.6346000      0.4596000      -1.713500    
 H   -2.158400       3.985100       1.594200    
 H    4.594800     -0.7452000     -0.3365000    
 H   -2.107200       4.478700     -0.8536000    
 H  -7.0600003E-02   1.813000      -3.517500    
 H   -4.318700     -0.8836000     -0.9440000    
 H   -5.457900      -1.845200      7.3000002E-03
 H   -4.080900      -1.159600      0.8076000    
 H   -5.337300      -3.922500      -1.097600    
 H   -4.440800      -3.087900      -2.386000    
 H   -3.796100      -4.566600      -1.639800    
 H   -1.404600       3.863000      -3.130800    
 H    4.666900      0.3014000      -2.729700    
 H    3.813500       1.234300      -1.533000    
 H    2.896800      0.2540000      -2.680800    
 H    5.311500      -2.059000      -2.319800    
 H    4.333100      -3.042000      -1.206600    
 H    3.609300      -2.429300      -2.686000    


%chk=000025900-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025900

0 1
O 2.463432 -1.057194 -0.782834
O 2.775683 0.800895 0.578982
N -3.616653 -3.192751 -0.264656
C 0.624423 -0.438707 0.727037
C 0.882068 -1.220103 2.097340
C -0.210764 -1.345207 -0.251603
C -0.144367 0.900982 0.928964
C -1.571808 -1.817725 0.308075
C 2.037776 -0.128407 0.177679
C 1.782505 -0.461235 3.106890
C 1.453019 -2.645050 1.885880
C -0.250147 1.877210 -0.146367
C -2.392706 -2.534716 -0.784774
C -0.831680 1.163588 2.122320
C -1.024865 3.089257 0.066991
C -1.599966 2.349617 2.324277
C 0.364113 1.717345 -1.437828
C -1.690484 3.304524 1.316784
C 3.867739 -0.888196 -1.316271
C -1.129674 4.067982 -0.977436
C 0.242338 2.683827 -2.437806
C -4.622945 -2.234114 0.237092
C -4.201543 -4.120481 -1.254807
C -0.508259 3.877933 -2.210599
C 3.854278 0.164467 -2.433975
C 4.292198 -2.283542 -1.779491
H -0.118615 -1.346664 2.554317
H 0.398506 -2.217618 -0.542726
H -0.397026 -0.778086 -1.182708
H -2.131993 -0.949081 0.701097
H -1.435347 -2.528591 1.145079
H 1.687383 -0.924860 4.106879
H 2.845017 -0.512444 2.811277
H 1.523893 0.606292 3.189731
H 1.641949 -3.109512 2.871352
H 2.410923 -2.622800 1.335542
H 0.760912 -3.304666 1.335077
H -2.633681 -1.802875 -1.602631
H -1.762217 -3.324881 -1.239094
H -0.788185 0.449727 2.947952
H -2.110097 2.499429 3.282084
H 0.943967 0.819139 -1.662998
H -2.269752 4.224312 1.460455
H 4.489617 -0.532108 -0.473914
H -1.715664 4.974737 -0.783979
H 0.727646 2.524713 -3.407412
H -4.988573 -1.528671 -0.553698
H -5.493753 -2.788866 0.630348
H -4.205201 -1.634193 1.062607
H -5.060590 -4.650840 -0.805489
H -4.561449 -3.611281 -2.186334
H -3.449392 -4.874888 -1.547805
H -0.594060 4.631281 -3.001175
H 4.869668 0.273708 -2.857548
H 3.537901 1.146304 -2.044047
H 3.172539 -0.142413 -3.247888
H 5.326797 -2.252089 -2.166985
H 4.254311 -3.004979 -0.945170
H 3.629556 -2.646635 -2.584858


