%chk=000130560.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130560

0 1
 O   0.5402000      0.9161000       1.117300    
 O    1.475200      -2.338000       1.056200    
 O   -2.126800     -0.7442000      -1.348800    
 O    1.979100      -3.933200      -1.065800    
 O   -3.383500     -0.1072000       1.991100    
 N   0.2495000      0.6323000      -1.168200    
 N    2.223400      -2.554600      -1.118500    
 N   -3.212700       1.089300     -0.4302000    
 N   -5.546100     -0.8034000       1.637800    
 C    3.288500      5.1300000E-02  0.8939000    
 C    3.651000       1.551900      0.8637000    
 C    2.200000     -0.3522000     -0.1239000    
 C   0.9114000      0.4583000      3.9299998E-02
 C    4.684900       1.855400       1.952100    
 C    4.183400       2.014300     -0.4922000    
 C  -0.9758000       1.387800      -1.291800    
 C    1.927400      -1.849100      2.2700001E-02
 C   -1.095500       2.026700      -2.666700    
 C   -2.140100      0.4423000      -1.027700    
 C   -4.452500      0.4176000     -0.1174000    
 C   -4.381000     -0.1613000       1.276900    
 H    2.951800     -0.2073000       1.907100    
 H    4.189600     -0.5494000      0.7112000    
 H    2.762800       2.149900       1.096100    
 H    2.594800     -0.1657000      -1.130600    
 H    5.616500       1.305800       1.779300    
 H    4.921900       2.924300       1.978200    
 H    4.303500       1.575700       2.939900    
 H    4.508200       3.059500     -0.4473000    
 H    3.413200       1.950300      -1.266600    
 H    5.038900       1.408500     -0.8092000    
 H  -0.9667000       2.174400     -0.5278000    
 H   0.5966000      0.1528000      -1.994100    
 H   -1.113700       1.267900      -3.457400    
 H   -2.017700       2.611500      -2.748700    
 H  -0.2477000       2.691800      -2.862800    
 H    2.705800      -2.205300      -1.938400    
 H   -3.137000       2.074900     -0.1965000    
 H   -4.638300     -0.3836000     -0.8395000    
 H   -5.258600       1.155500     -0.1684000    
 H    1.094000      -3.966400      -1.466700    
 H   -5.635500      -1.252500       2.543200    
 H   -6.353600     -0.8475000       1.024400    


%chk=000130560-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130560

0 1
O 1.255440 1.194574 1.703121
O 3.776107 -2.357991 1.054747
O -1.731540 -0.772911 -1.635451
O 1.570940 -3.666152 1.706829
O -5.881056 0.935512 0.331607
N 0.213851 0.195080 -0.113197
N 1.505844 -2.333048 1.173378
N -3.431762 0.240162 -0.428868
N -6.967352 -0.422964 -1.210977
C 3.866714 0.518121 0.644946
C 4.072883 1.809535 -0.189298
C 2.608982 -0.296142 0.257985
C 1.317833 0.442007 0.683039
C 5.210237 2.649114 0.439615
C 4.384485 1.510309 -1.676100
C -1.095104 0.816106 0.137245
C 2.685770 -1.712193 0.864291
C -1.104939 2.325158 -0.231250
C -2.113085 0.021968 -0.711727
C -4.499407 -0.405357 -1.185971
C -5.840206 0.097212 -0.618914
H 3.772733 0.789328 1.712788
H 4.748101 -0.142231 0.544815
H 3.141320 2.411338 -0.136498
H 2.591921 -0.442091 -0.842097
H 6.160111 2.079970 0.442679
H 5.378325 3.584416 -0.126278
H 4.973313 2.919384 1.485049
H 4.537340 2.448636 -2.241133
H 3.569549 0.955446 -2.178546
H 5.308318 0.906761 -1.765107
H -1.331913 0.720445 1.214835
H 0.256946 -0.380914 -0.965843
H -0.899733 2.463450 -1.307136
H -2.081115 2.786245 0.003274
H -0.327676 2.840878 0.355703
H 0.553976 -1.975511 1.105856
H -3.753777 0.874112 0.315416
H -4.430046 -1.507823 -1.101398
H -4.416766 -0.164494 -2.264021
H 2.574531 -3.808806 1.720338
H -7.880690 -0.122344 -0.870698
H -6.920606 -1.099094 -1.971846


