%chk=000062277.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062277

0 1
 O   0.8638000      -1.647000       1.627200    
 O    3.419500       1.128000      -1.014600    
 O   0.4250000       3.409900      0.2496000    
 O   -1.162200      -2.102100      -1.110500    
 O    3.511900      -2.357100     -0.5509000    
 O   -2.306700      0.9059000       1.502100    
 O   -5.419200     -0.7787000     -0.7486000    
 N    1.211800       1.268500     -0.2312000    
 N  -0.8444000     -8.2000000E-03 -6.0500000E-02
 N    2.448800     -0.4921000      0.3604000    
 N   -3.202000     -0.2865000     -0.2471000    
 C   0.3250000      0.4872000      0.5991000    
 C    1.218300     -0.6895000      0.9518000    
 C    2.476700      0.6831000     -0.3717000    
 C   0.8090000       2.539800     -0.7973000    
 C  -0.6358000     -0.7970000      -1.287800    
 C    3.571200      -1.400200      0.4892000    
 C   -2.136900      0.2524000      0.4685000    
 C   -4.573700     -0.1165000      0.1723000    
 H   9.9200003E-02   1.047500       1.511700    
 H    1.638700       2.984200      -1.354100    
 H  -3.9299998E-02   2.375300      -1.467800    
 H   -1.177200     -0.3123000      -2.106400    
 H   0.4155000     -0.8747000      -1.573100    
 H    3.517200      -1.917900       1.451300    
 H    4.508200     -0.8423000      0.4055000    
 H   -3.034500     -0.8431000      -1.077000    
 H   0.1479000       4.246700     -0.1609000    
 H  -0.7721000      -2.453500     -0.2924000    
 H    4.274100      -2.950200     -0.4382000    
 H   -4.697600     -0.5482000       1.169800    
 H   -4.809700      0.9515000      0.1953000    
 H   -6.332700     -0.6482000     -0.4425000    


%chk=000062277-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062277

0 1
O 0.980775 -2.012473 1.312814
O 3.507651 1.258705 -0.928574
O 0.130411 3.175774 0.180416
O -1.483789 -2.625918 -0.150186
O 4.323272 -1.641970 -0.844915
O -2.106244 1.634409 0.583480
O -5.335455 0.353373 -0.981126
N 1.164127 1.088860 -0.477462
N -0.926998 -0.248802 -0.182139
N 2.552274 -0.508719 0.355006
N -3.265995 -0.346405 0.114064
C 0.323269 0.234542 0.393177
C 1.295248 -0.921046 0.765211
C 2.496275 0.719306 -0.414409
C 0.672501 2.421361 -0.916542
C -0.971610 -1.510705 -0.941612
C 3.820052 -1.266895 0.455131
C -2.118167 0.414359 0.195939
C -4.597724 0.241160 0.275283
H 0.070075 0.806966 1.308713
H 1.541052 2.966847 -1.315982
H -0.079698 2.258272 -1.714076
H -1.676349 -1.414897 -1.781925
H 0.041386 -1.714631 -1.334030
H 3.598952 -2.196701 0.999393
H 4.542412 -0.641513 1.012898
H -3.160570 -1.367559 0.032536
H -0.783091 2.805412 0.398928
H -0.824066 -2.806709 0.577754
H 4.662646 -0.824843 -1.297854
H -5.216386 -0.431266 0.887888
H -4.472891 1.218761 0.773860
H -4.965546 1.097647 -1.520460


