%chk=000149217.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149217

0 1
 O   -3.159900       1.330600      -1.523200    
 O    3.166100       1.340400       1.516800    
 O   -1.747200       1.405100       2.855500    
 O    1.741200       1.386900      -2.858300    
 N   -4.364500      0.2306000      9.7000003E-02
 N    4.365700      0.2302000     -9.9900000E-02
 N   -2.392400       1.406000      0.6623000    
 N    2.376300       1.413300     -0.6627000    
 N   -2.613500      0.9913000       2.077600    
 N    2.609700      0.9781000      -2.080100    
 C   -5.379800     -0.2527000     -0.8122000    
 C    5.383600     -0.2473000      0.8095000    
 C   -6.739800     -0.3579000     -0.1137000    
 C   -4.969800      -1.591800      -1.434300    
 C    4.975200      -1.582400       1.441200    
 C    6.741600     -0.3570000      0.1080000    
 C   -6.796000      -1.512900      0.8862000    
 C   -5.029000      -2.744800     -0.4322000    
 C    5.031700      -2.741600      0.4464000    
 C    6.795100      -1.518300     -0.8846000    
 C   -6.394900      -2.836000      0.2412000    
 C    6.395800      -2.837200     -0.2301000    
 C   -3.295100       1.011200     -0.3376000    
 C    3.297900       1.013500      0.3329000    
 C   1.0000000E-03   1.391700      1.0000000E-03
 C   -1.228400       2.226700      0.3528000    
 C    1.229300       2.224400     -0.3594000    
 H   -5.474700      0.4825000      -1.621000    
 H    5.480800      0.4930000       1.613300    
 H   -6.976700      0.5806000      0.4018000    
 H   -7.519000     -0.5101000     -0.8715000    
 H   -5.645700      -1.817500      -2.269100    
 H   -3.959000      -1.529000      -1.854700    
 H    3.965700      -1.516900       1.864100    
 H    5.653500      -1.802800       2.275600    
 H    7.522900     -0.5044000      0.8646000    
 H    6.977100      0.5782000     -0.4141000    
 H   -6.138900      -1.305800       1.738900    
 H   -7.812300      -1.596600       1.288100    
 H   -4.809700      -3.687900     -0.9457000    
 H   -4.252600      -2.612100      0.3310000    
 H    4.253200      -2.613700     -0.3155000    
 H    4.813700      -3.681400      0.9665000    
 H    7.810400      -1.604700      -1.288800    
 H    6.135800      -1.316700      -1.736900    
 H   -7.149000      -3.121500     -0.5027000    
 H   -6.380500      -3.626800      0.9997000    
 H    7.151800      -3.118100      0.5135000    
 H    6.379200      -3.632800     -0.9835000    
 H   -4.400900     -9.1100000E-02   1.056900    
 H    4.399400     -9.7700000E-02  -1.057900    
 H   0.2449000      0.7318000      0.8437000    
 H  -0.2435000      0.7234000     -0.8349000    
 H   -1.478300       2.859500     -0.5079000    
 H   -1.017000       2.913100       1.180500    
 H    1.011900       2.906300      -1.189400    
 H    1.477400       2.864200      0.4966000    


%chk=000149217-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149217

0 1
O -3.271318 1.450769 -1.513459
O 3.264411 1.484628 1.486510
O -1.736088 1.025678 2.810018
O 1.731428 0.981799 -2.829160
N -4.493846 0.279307 0.111672
N 4.490656 0.288875 -0.118024
N -2.417314 1.287376 0.676953
N 2.411748 1.281616 -0.701089
N -2.650339 0.772129 1.949820
N 2.646150 0.744994 -1.964656
C -5.612657 -0.108325 -0.781210
C 5.609422 -0.081697 0.782033
C -6.889208 -0.339098 0.064406
C -5.262365 -1.371119 -1.616006
C 5.264081 -1.336701 1.630565
C 6.889577 -0.315485 -0.057350
C -6.806796 -1.619417 0.933877
C -5.170424 -2.642913 -0.741378
C 5.179655 -2.618500 0.769778
C 6.815216 -1.605622 -0.913044
C -6.468387 -2.861316 0.074070
C 6.480178 -2.839769 -0.040852
C -3.433279 1.009540 -0.341514
C 3.428028 1.024000 0.322280
C -0.003382 1.178625 -0.013591
C -1.214887 2.075437 0.336638
C 1.207130 2.072429 -0.374636
H -5.769391 0.738754 -1.474622
H 5.759308 0.774430 1.465679
H -7.090952 0.550870 0.691042
H -7.740078 -0.439441 -0.637711
H -6.055998 -1.503278 -2.379439
H -4.317786 -1.193372 -2.162191
H 4.317716 -1.157568 2.173247
H 6.057155 -1.456659 2.396570
H 7.738868 -0.404369 0.648217
H 7.088883 0.568457 -0.693168
H -6.037706 -1.502581 1.727158
H -7.767455 -1.767127 1.462873
H -4.967488 -3.522835 -1.381002
H -4.310514 -2.552779 -0.046285
H 4.320631 -2.539857 0.072198
H 4.979554 -3.492297 1.418612
H 7.777800 -1.754779 -1.438118
H 6.047698 -1.500505 -1.709428
H -7.308166 -3.057685 -0.624709
H -6.371411 -3.756125 0.718330
H 7.319345 -3.025449 0.661583
H 6.388210 -3.741670 -0.675894
H -4.482076 -0.011390 1.094011
H 4.479800 -0.019204 -1.095073
H 0.254676 0.543578 0.852321
H -0.260680 0.532628 -0.871552
H -1.487965 2.706969 -0.524365
H -0.978693 2.705222 1.213926
H 0.971510 2.689235 -1.261259
H 1.477616 2.716688 0.477696


