%chk=000018666.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018666

0 1
 O    1.483500      0.1636000     -0.9410000    
 O    2.172200     -0.2205000       1.246300    
 N    3.197400      -1.303400     -0.5307000    
 C   -1.110100     -0.8658000     -0.2785000    
 C   -1.518700      -1.510900       1.057800    
 C   -2.286600      -1.123000      -1.242900    
 C   -2.622300      -2.491800      0.6917000    
 C   -3.384700      -1.757800     -0.3971000    
 C  -0.7301000      0.5902000     -0.1265000    
 C   0.5492000       1.033500     -0.4647000    
 C   -1.674400       1.495800      0.3589000    
 C   0.8835000       2.379600     -0.3177000    
 C   -1.340200       2.842100      0.5058000    
 C  -6.1099999E-02   3.283900      0.1675000    
 C    2.285100     -0.4431000      4.4500001E-02
 C    4.157500      -2.072400      0.2266000    
 H  -0.2614000      -1.438300     -0.6715000    
 H   -1.905400     -0.7836000       1.780800    
 H  -0.6724000      -2.015500       1.536600    
 H   -1.969400      -1.835500      -2.015100    
 H   -2.644100     -0.2278000      -1.762300    
 H   -3.255400      -2.743400       1.547200    
 H   -2.191300      -3.419500      0.2971000    
 H   -4.023100      -2.426200     -0.9819000    
 H   -4.019200     -0.9799000      4.3400001E-02
 H   -2.678700       1.175700      0.6226000    
 H    1.877700       2.731400     -0.5800000    
 H   -2.076100       3.546600      0.8820000    
 H   0.1989000       4.332200      0.2814000    
 H    3.192500      -1.402800      -1.541200    
 H    3.977500      -3.131900      2.8800000E-02
 H    4.070900      -1.875100       1.297600    
 H    5.158400      -1.805000     -0.1205000    


%chk=000018666-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018666

0 1
O 1.569690 0.279054 -0.851503
O 1.848556 -0.681888 1.310114
N 3.101481 -1.362400 -0.564187
C -1.164028 -0.697930 -0.181330
C -1.571101 -1.320742 1.187740
C -2.401524 -0.987594 -1.095702
C -2.267568 -2.637088 0.774017
C -3.096390 -2.256449 -0.492924
C -0.748341 0.762806 -0.103314
C 0.569043 1.199808 -0.391665
C -1.677765 1.767659 0.278551
C 0.952977 2.554041 -0.324300
C -1.316582 3.128734 0.357299
C 0.004968 3.528922 0.049715
C 2.157996 -0.613635 0.098373
C 3.904481 -2.381821 0.114709
H -0.314311 -1.289801 -0.569450
H -2.286312 -0.651085 1.705582
H -0.697831 -1.458791 1.847183
H -2.089924 -1.136161 -2.145131
H -3.093238 -0.125897 -1.089441
H -2.893427 -3.064801 1.577814
H -1.501745 -3.393928 0.514813
H -3.138012 -3.089673 -1.217202
H -4.139933 -2.021730 -0.212256
H -2.706165 1.471700 0.518477
H 1.985713 2.824611 -0.565862
H -2.060788 3.875291 0.655897
H 0.295092 4.583616 0.103690
H 3.235183 -1.171206 -1.557378
H 3.747185 -3.380635 -0.332788
H 3.590092 -2.414556 1.169942
H 4.982127 -2.137031 0.075521


