%chk=000090941.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090941

0 1
 O   -1.025600       1.476800      0.6674000    
 O    2.777100       1.928600      0.2461000    
 O    1.774700      0.9389000      -1.546100    
 N   0.1720000     -0.4417000      0.1761000    
 C    1.457200      3.2400001E-02  0.6725000    
 C    2.316500      -1.221800      0.7824000    
 C    1.749500      -2.136400     -0.3005000    
 C   0.2600000      -1.828800     -0.2733000    
 C  -0.9899000      0.3066000      0.2836000    
 C    1.998000      0.9904000     -0.3457000    
 C   -2.258700     -0.4022000     -0.1183000    
 C   -3.455300      0.5193000      4.3699998E-02
 C   -4.775600     -0.1622000     -0.2878000    
 H    1.315000      0.5451000       1.629900    
 H    2.168000      -1.688200       1.763900    
 H    3.386400      -1.035800      0.6484000    
 H    2.172300      -1.867300      -1.275700    
 H    1.963300      -3.193500     -0.1197000    
 H  -0.2126000      -1.952700      -1.251400    
 H  -0.2604000      -2.455600      0.4587000    
 H   -2.384100      -1.290200      0.5110000    
 H   -2.177700     -0.7205000      -1.163100    
 H   -3.341400       1.398900     -0.6021000    
 H   -3.508500      0.8910000       1.074600    
 H   -4.947800      -1.020800      0.3691000    
 H   -4.783400     -0.5147000      -1.324000    
 H   -5.607300      0.5375000     -0.1592000    
 H    3.142500       2.565100     -0.4049000    


%chk=000090941-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090941

0 1
O -0.890351 1.515841 0.633027
O 2.853463 1.945089 0.158504
O 1.717601 0.974649 -1.622548
N 0.150312 -0.516023 0.299735
C 1.455643 0.054528 0.680134
C 2.369399 -1.200689 0.795648
C 1.772405 -2.173333 -0.254357
C 0.246156 -1.928088 -0.153582
C -0.976115 0.292816 0.290737
C 1.970067 1.015536 -0.400534
C -2.286655 -0.364835 -0.152721
C -3.521308 0.505449 0.156056
C -4.823551 -0.120472 -0.384666
H 1.382118 0.623789 1.620477
H 2.273325 -1.616900 1.814653
H 3.431666 -0.965362 0.620115
H 2.127881 -1.904761 -1.264319
H 2.038369 -3.225557 -0.059670
H -0.261568 -2.069087 -1.123999
H -0.223718 -2.608309 0.585563
H -2.390196 -1.361962 0.321686
H -2.227834 -0.551563 -1.246541
H -3.365198 1.510137 -0.275809
H -3.595145 0.655815 1.249711
H -5.006453 -1.119700 0.055373
H -4.783132 -0.240218 -1.484296
H -5.696649 0.514676 -0.148689
H 3.183668 2.556733 -0.554089


