%chk=000085627.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085627

0 1
 O    7.239400       2.086400     -0.2403000    
 O    7.559000     -7.0900001E-02 -0.4910000    
 N   -4.751300     -0.7216000      0.4491000    
 N   0.7165000      7.1099997E-02 -0.4573000    
 N    1.338500      2.7500000E-02  0.6288000    
 N    6.807100      0.9088000     -0.2694000    
 N   -7.581300       3.178500     -0.1294000    
 N    2.670900      -3.281100      9.4400004E-02
 C   -5.621300      0.4054000      0.7201000    
 C   -5.312000      -2.057900      0.4293000    
 C   -3.373800     -0.5217000      0.2209000    
 C   -6.009600       1.115700     -0.5724000    
 C   -2.843200      0.7682000      0.2419000    
 C   -2.542000      -1.614000     -2.5699999E-02
 C   -5.556500      -2.500500      -1.000700    
 C   -1.480900      0.9659000      1.6000001E-02
 C   -1.179800      -1.416200     -0.2515000    
 C  -0.6561000     -0.1273000     -0.2294000    
 C   -6.888100       2.268400     -0.3235000    
 C    2.707600      0.2252000      0.4011000    
 C    3.562000     -0.8490000      0.1523000    
 C    3.211400       1.525500      0.4271000    
 C    5.424100      0.6777000     -4.4399999E-02
 C    4.920300     -0.6228000     -7.0500001E-02
 C    4.569600       1.751900      0.2043000    
 C    3.069700      -2.193000      0.1203000    
 H   -5.187500       1.093900       1.456600    
 H   -6.541800      5.6100000E-02   1.208200    
 H   -4.698300      -2.779900      0.9796000    
 H   -6.276100      -2.072300      0.9534000    
 H   -6.533100      0.4174000      -1.235200    
 H   -5.130800       1.454900      -1.130100    
 H   -3.432600       1.657900      0.4332000    
 H   -2.889300      -2.640600     -5.4299999E-02
 H   -5.952500      -3.521400      -1.011300    
 H   -6.294200      -1.859400      -1.492900    
 H   -4.651600      -2.489400      -1.614400    
 H   -1.074700       1.973800      3.4400001E-02
 H  -0.5384000      -2.272200     -0.4439000    
 H    2.554400       2.369600      0.6212000    
 H    5.570800      -1.474000     -0.2627000    
 H    4.926700       2.778200      0.2325000    


%chk=000085627-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085627

0 1
O 7.902586 -0.322121 0.424132
O 7.510984 1.371139 -1.057909
N -4.914615 -0.287336 0.559494
N 0.668357 0.364151 -0.144097
N 1.512420 -0.382645 0.541375
N 7.109959 0.449238 -0.245692
N -7.714856 1.366923 -3.146846
N 1.978815 2.612767 -2.098289
C -5.853858 0.487391 -0.267963
C -5.487873 -1.266569 1.517581
C -3.535069 -0.158194 0.389299
C -6.010822 -0.095381 -1.713706
C -2.979490 0.803585 -0.523626
C -2.614887 -0.978773 1.136396
C -5.580078 -2.712728 0.976827
C -1.595975 0.943651 -0.661823
C -1.235594 -0.835762 0.992964
C -0.695560 0.131161 0.087691
C -6.946822 0.703442 -2.519241
C 2.873462 -0.087846 0.265063
C 3.370194 0.927629 -0.632731
C 3.806266 -0.898930 0.971493
C 5.653628 0.262405 -0.068341
C 4.768381 1.089518 -0.787003
C 5.189486 -0.738551 0.816399
C 2.525624 1.809006 -1.398894
H -5.535990 1.543401 -0.330987
H -6.840257 0.481589 0.224932
H -4.894612 -1.244369 2.449566
H -6.497625 -0.910423 1.788975
H -6.378418 -1.136280 -1.659823
H -5.027691 -0.123810 -2.218289
H -3.627534 1.455870 -1.114463
H -2.991653 -1.734526 1.829804
H -5.972206 -3.383778 1.762480
H -6.261088 -2.776622 0.109797
H -4.591741 -3.091059 0.663829
H -1.168991 1.681710 -1.348757
H -0.544001 -1.461783 1.565027
H 3.396042 -1.657320 1.644388
H 5.171853 1.851258 -1.459501
H 5.910452 -1.358228 1.354870


