%chk=000101255.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101255

0 1
 O    2.360000     -0.7204000      -1.089400    
 O    1.664600       1.825800       1.350700    
 O    3.804300       1.853900     -0.3244000    
 O   -4.159100      -1.683600      0.3880000    
 N   0.1763000     -0.5331000     -0.1803000    
 N   -1.458600       1.261700     -0.3299000    
 N   -1.262800      -2.209400      0.2200000    
 N   -3.733100      0.5587000     -1.5200000E-02
 N   -3.171900       2.809800     -0.4314000    
 C    1.445300      0.1559000     -0.4034000    
 C    2.149500      0.5871000      0.8740000    
 C    3.593100      0.6514000      0.4156000    
 C    3.684600     -0.5355000     -0.5383000    
 C    4.099500      -1.824700      0.1567000    
 C   -1.069500     -4.1000000E-03 -0.1569000    
 C   7.1999999E-03  -1.880000      5.4000001E-02
 C   -1.937100      -1.028500      8.6700000E-02
 C   -3.362200     -0.7789000      0.1710000    
 C   -2.830100       1.493900     -0.2475000    
 H    1.234800       1.001800      -1.069000    
 H    2.033500     -0.1627000       1.665100    
 H    4.311900      0.6342000       1.239900    
 H    4.363300     -0.3373000      -1.374900    
 H    4.098300      -2.656000     -0.5566000    
 H    5.101200      -1.735700      0.5874000    
 H    3.398100      -2.097100      0.9523000    
 H   0.8395000      -2.569300      9.7900003E-02
 H    1.816300       2.493900      0.6608000    
 H    4.723800       1.841900     -0.6407000    
 H  -0.8163000       2.027000     -0.5071000    
 H   -2.469500       3.519100     -0.6096000    
 H   -4.139800       3.110400     -0.3953000    


%chk=000101255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101255

0 1
O 2.551947 -1.086884 -0.979114
O 1.376996 2.212184 0.138143
O 3.785092 1.811687 -0.747866
O -4.345734 -1.623267 0.043279
N 0.213395 -0.773250 -0.646983
N -1.240654 1.170057 -0.029444
N -1.395613 -2.401199 -0.657480
N -3.571883 0.583998 0.300042
N -2.848020 2.792007 0.586207
C 1.493240 -0.087323 -0.878401
C 1.890446 0.857909 0.299859
C 3.436172 0.801569 0.267945
C 3.740702 -0.649075 -0.172199
C 3.947552 -1.619281 0.998487
C -0.995303 -0.163283 -0.321728
C -0.097663 -2.145752 -0.855888
C -1.982619 -1.162243 -0.321156
C -3.380839 -0.813272 0.007781
C -2.585104 1.466769 0.281971
H 1.442603 0.494223 -1.822752
H 1.495212 0.467985 1.251396
H 3.895795 1.049650 1.242649
H 4.605199 -0.678951 -0.861228
H 3.990622 -2.652702 0.616694
H 4.897350 -1.406671 1.523489
H 3.119662 -1.563823 1.727405
H 0.672038 -2.859226 -1.131513
H 2.043935 2.696316 -0.426083
H 4.760246 1.957901 -0.792380
H -0.470179 1.858940 0.008684
H -2.136796 3.517685 0.586042
H -3.812702 3.017522 0.814342


