%chk=000101563.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101563

0 1
 O   -4.037700      -1.648900       1.340200    
 O   -3.996600      -2.363400     -0.8298000    
 N   -4.608200      0.8767000     -9.3300000E-02
 C   -3.507900     -9.7400002E-02 -0.3839000    
 C   -2.225300      0.4651000      0.2384000    
 C  -0.9637000     -9.2100002E-02 -0.4327000    
 C   0.3026000      0.4651000      0.2228000    
 C   -5.970700      0.2349000     -0.3631000    
 C   -4.468200       2.116300     -0.9791000    
 C   -4.556100       1.314800       1.371700    
 C    1.596100     -7.8400001E-02 -0.3913000    
 C    2.862100      0.4595000      0.2812000    
 C   -3.879300      -1.509500      9.5399998E-02
 C    4.121000     -0.1253000     -0.3640000    
 C    5.420800      0.3540000      0.2898000    
 C    6.715300     -0.2159000     -0.2983000    
 C    7.974400      0.2543000      0.4299000    
 C    9.221500     -0.4096000     -0.1339000    
 H   -3.404500     -0.1277000      -1.477400    
 H   -2.140200       1.551700      0.1607000    
 H   -2.168000      0.2115000       1.304900    
 H  -0.9669000      0.1655000      -1.498700    
 H  -0.9594000      -1.186300     -0.3626000    
 H   0.3021000       1.559200      0.1431000    
 H   0.2900000      0.2258000       1.293500    
 H   -6.734200       1.017100     -0.2982000    
 H   -6.184600     -0.5254000      0.3923000    
 H   -5.961900     -0.1888000      -1.371900    
 H   -3.544200       2.650500     -0.7539000    
 H   -5.319400       2.774800     -0.7784000    
 H   -4.485900       1.796900      -2.025500    
 H   -3.694200       1.960500       1.556900    
 H   -5.456100       1.912100       1.559900    
 H   -4.571600      0.4580000       2.043400    
 H    1.589400      -1.173500     -0.3242000    
 H    1.618000      0.1731000      -1.459000    
 H    2.845200      0.2079000       1.348300    
 H    2.883500       1.553100      0.2059000    
 H    4.080900      -1.220200     -0.3094000    
 H    4.140200      0.1378000      -1.428700    
 H    5.383900      0.1048000       1.358100    
 H    5.461400       1.449100      0.2304000    
 H    6.664500      -1.311300     -0.2619000    
 H    6.780600      6.1700001E-02  -1.357500    
 H    8.068700       1.342700      0.3424000    
 H    7.895800      1.9600000E-02   1.497700    
 H    9.170100      -1.497800     -2.6300000E-02
 H    10.11110     -5.7599999E-02  0.3978000    
 H    9.344800     -0.1742000      -1.195900    


%chk=000101563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101563

0 1
O -4.546131 -1.569588 1.275039
O -3.052019 -2.357016 -0.355864
N -4.773354 0.939313 -0.111133
C -3.507322 -0.003542 -0.323921
C -2.220352 0.610026 0.279963
C -0.950388 -0.003292 -0.360948
C 0.346025 0.493355 0.314965
C -6.017766 0.186536 -0.581042
C -4.637042 2.202534 -0.942342
C -4.948374 1.296893 1.363854
C 1.619673 -0.099994 -0.328207
C 2.926474 0.395943 0.330290
C -3.742417 -1.466577 0.256428
C 4.198812 -0.208370 -0.305571
C 5.508009 0.305579 0.334851
C 6.780210 -0.305581 -0.294830
C 8.089873 0.220351 0.336036
C 9.355660 -0.399049 -0.295340
H -3.414025 -0.074036 -1.425366
H -2.177145 1.710669 0.135868
H -2.202149 0.421395 1.370513
H -0.924021 0.254860 -1.440777
H -1.022192 -1.104285 -0.304909
H 0.397000 1.602956 0.269301
H 0.323755 0.224816 1.391766
H -6.885243 0.864822 -0.526171
H -6.138818 -0.683739 0.081480
H -5.856398 -0.146623 -1.618569
H -3.740424 2.757884 -0.632836
H -5.529808 2.831300 -0.789864
H -4.552056 1.924358 -2.004706
H -4.101848 1.921926 1.684066
H -5.895080 1.850558 1.479039
H -4.957417 0.329297 1.899375
H 1.573707 -1.206708 -0.268975
H 1.636473 0.152049 -1.409460
H 2.907229 0.151347 1.413020
H 2.974398 1.503597 0.262850
H 4.159100 -1.314490 -0.221755
H 4.209042 0.019599 -1.392218
H 5.495543 0.083808 1.422696
H 5.549972 1.411662 0.244340
H 6.744973 -1.410739 -0.194791
H 6.789097 -0.093519 -1.384723
H 8.125526 1.324347 0.232569
H 8.078216 0.011125 1.425360
H 9.359958 -1.499028 -0.175393
H 10.277483 -0.004772 0.170951
H 9.404782 -0.181162 -1.379109


