%chk=000089163.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089163

0 1
 O   -2.495400     -0.7677000      0.3714000    
 O   -3.780100      0.8599000     -0.6469000    
 N   0.2597000     -0.2267000      0.6815000    
 N    2.566800      -4.308900     -0.5701000    
 C  -0.6598000     -0.2148000       1.801900    
 C   0.5872000      -1.489600      5.0200000E-02
 C   0.8390000      0.9737000      0.2203000    
 C   -2.057600      0.1710000       1.345000    
 C    1.923500      -2.021000      0.5578000    
 C    1.733200      0.9503000     -0.8498000    
 C   0.5171000       2.184300      0.8339000    
 C    2.305600       2.137500      -1.306700    
 C    1.089400       3.371600      0.3770000    
 C    1.983600       3.348100     -0.6933000    
 C    2.281900      -3.299800     -7.3200002E-02
 C   -3.360500     -0.2870000     -0.5724000    
 C   -3.733700      -1.380900      -1.526500    
 H  -0.3122000      0.4142000       2.628900    
 H  -0.7097000      -1.225400       2.229600    
 H   0.5541000      -1.425700      -1.044900    
 H  -0.1873000      -2.232900      0.2864000    
 H   -2.075100       1.193800      0.9560000    
 H   -2.744400      0.1216000       2.197100    
 H    2.734600      -1.305100      0.3895000    
 H    1.869400      -2.162100       1.644700    
 H    2.021300      4.5400001E-02  -1.373100    
 H  -0.1660000       2.271900       1.671100    
 H    3.001100       2.120400      -2.140800    
 H   0.8400000       4.314800      0.8545000    
 H    2.429200       4.272500      -1.049100    
 H   -4.239300      -2.185800     -0.9874000    
 H   -2.837700      -1.756100      -2.027400    
 H   -4.416200     -0.9849000      -2.283800    


%chk=000089163-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089163

0 1
O -2.566638 -0.815900 0.161971
O -4.566043 0.331893 -0.169670
N 0.335991 -0.085937 0.534038
N 2.418403 -4.372341 -0.715300
C -0.717847 -0.102050 1.559123
C 0.645487 -1.352714 -0.133570
C 1.019727 1.105470 0.206007
C -2.109729 0.294681 1.046223
C 1.868940 -2.080593 0.526635
C 2.099601 1.106792 -0.732593
C 0.659580 2.356935 0.797941
C 2.779412 2.299042 -1.053223
C 1.355390 3.538968 0.472594
C 2.421771 3.528259 -0.454462
C 2.189678 -3.348461 -0.145423
C -3.844412 -0.661637 -0.402566
C -4.177569 -1.840054 -1.289682
H -0.446329 0.568220 2.396664
H -0.785466 -1.120914 1.983077
H 0.850439 -1.188382 -1.206453
H -0.240146 -2.006495 -0.079136
H -2.090633 1.230894 0.462319
H -2.831319 0.408130 1.877068
H 2.753855 -1.418347 0.502830
H 1.644367 -2.282098 1.591048
H 2.417290 0.180801 -1.221036
H -0.171317 2.423464 1.506272
H 3.601362 2.260926 -1.777488
H 1.050317 4.479752 0.945429
H 2.955518 4.450216 -0.705338
H -4.124398 -2.780565 -0.714586
H -3.445839 -1.916232 -2.112721
H -5.187742 -1.715126 -1.704595


