%chk=000159624.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159624

0 1
 O   -3.004200     -0.2374000      4.6200000E-02
 O    6.264000      -1.169900     -0.2553000    
 O   -6.467900     -0.7006000      7.7100001E-02
 O   -4.799400      -2.116500      0.2986000    
 N   -5.225300     -0.9373000      0.1245000    
 N    6.252800       1.059000      0.2837000    
 C    1.366900     -0.1685000      2.4599999E-02
 C   -2.348200      0.9067000     -0.1127000    
 C  -8.7600000E-02 -0.1765000      3.0099999E-02
 C    2.058800       1.011600      0.2970000    
 C    2.069700      -1.340800     -0.2541000    
 C    4.156600     -0.1527000      1.2000000E-02
 C  -0.8749000      0.9176000     -9.8700002E-02
 C    3.453600       1.019500      0.2906000    
 C    3.464600      -1.332900     -0.2604000    
 C   -3.129100       1.983600     -0.2761000    
 C   -4.315700      0.1122000     -1.7700000E-02
 C   -4.445400       1.467300     -0.2149000    
 C    5.610800     -0.1443000      5.7000001E-03
 H  -0.5539000      -1.154100      0.1339000    
 H    1.555900       1.942500      0.5416000    
 H    1.547400      -2.269700     -0.4702000    
 H  -0.4342000       1.901300     -0.2350000    
 H    3.924900       1.968700      0.5153000    
 H    3.989700      -2.258600     -0.4804000    
 H   -2.835200       3.013400     -0.4219000    
 H   -5.369900       2.020300     -0.3043000    
 H    5.801300       1.938100      0.5002000    
 H    7.267500       1.092700      0.2787000    


%chk=000159624-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159624

0 1
O -2.984058 -0.239919 -0.092575
O 6.266214 -1.429922 0.023206
O -6.515776 -0.854663 -0.186739
O -4.733215 -2.314248 -0.221864
N -5.242708 -1.125491 -0.176207
N 6.492833 0.866405 0.160104
C 1.358853 0.003006 0.003539
C -2.367116 1.032504 -0.022192
C -0.104518 -0.000809 -0.026102
C 2.143802 1.192997 0.073838
C 2.045554 -1.246869 -0.040243
C 4.222059 -0.120652 0.055620
C -0.931092 1.099410 0.009236
C 3.546849 1.130898 0.099332
C 3.448442 -1.307302 -0.014818
C -3.366701 2.022997 0.003860
C -4.362534 0.001246 -0.108194
C -4.634874 1.366067 -0.050817
C 5.722808 -0.283029 0.077692
H -0.582399 -0.988333 -0.082413
H 1.655448 2.172856 0.108580
H 1.461974 -2.173502 -0.094732
H -0.524061 2.115468 0.065253
H 4.102357 2.074666 0.152218
H 3.982426 -2.262116 -0.048580
H -3.191196 3.095615 0.056217
H -5.625960 1.811494 -0.049525
H 6.104670 1.804645 0.210586
H 7.505518 0.751281 0.173820


