%chk=000045551.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045551

0 1
 O   -1.679400      -1.725600     -0.1928000    
 O   -3.284600      3.4200002E-02  0.1541000    
 N    2.668800      -1.010000     -0.1241000    
 C   0.2737000     -0.2452000     -0.1732000    
 C    1.269300      -1.347000     -0.4332000    
 C    2.149800       1.449100     -0.1256000    
 C   0.6841000       1.098200     -7.2899997E-02
 C    3.014400      0.3071000     -0.6723000    
 C   -1.086200     -0.5024000     -9.2900001E-02
 C  -0.2688000       2.119000      0.1372000    
 C   -2.007400      0.5019000      0.1025000    
 C    2.965200      -1.123600       1.302500    
 C   -1.630300       1.822300      0.2239000    
 C   -3.068700      -1.378100     -3.3199999E-02
 H   0.9807000      -2.254300      0.1123000    
 H    1.209300      -1.601100      -1.499600    
 H    2.294100       2.332600     -0.7590000    
 H    2.477800       1.711500      0.8877000    
 H    2.904800      0.2647000      -1.764600    
 H    4.074300      0.5280000     -0.4951000    
 H   5.5500001E-02   3.152500      0.2338000    
 H    2.811900      -2.155000       1.639400    
 H    2.347300     -0.4702000       1.927300    
 H    4.017700     -0.8877000       1.495300    
 H   -2.360600       2.608000      0.3809000    
 H   -3.466800      -1.912800      0.8368000    
 H   -3.616400      -1.701800     -0.9258000    


%chk=000045551-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045551

0 1
O -1.730122 -1.742009 -0.203307
O -3.348572 0.000791 0.156181
N 2.689099 -1.009683 -0.111338
C 0.288377 -0.234236 -0.191714
C 1.292884 -1.361766 -0.453946
C 2.187372 1.477660 -0.117932
C 0.699597 1.132283 -0.066190
C 3.039237 0.310615 -0.693672
C -1.086490 -0.474564 -0.104693
C -0.264431 2.152561 0.134765
C -2.035659 0.542458 0.101307
C 2.995286 -1.128433 1.331205
C -1.656455 1.881011 0.224129
C -3.181644 -1.463849 -0.034734
H 0.998788 -2.269260 0.103629
H 1.255159 -1.630360 -1.529851
H 2.345163 2.390496 -0.724436
H 2.542426 1.719209 0.904919
H 2.881762 0.240506 -1.787651
H 4.114912 0.502486 -0.523775
H 0.077350 3.190397 0.225190
H 2.838578 -2.174437 1.650158
H 2.379384 -0.474539 1.994490
H 4.059340 -0.878771 1.494417
H -2.392321 2.673798 0.378396
H -3.545937 -1.987909 0.866319
H -3.713581 -1.770155 -0.952466


