%chk=000084885.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084885

0 1
 O  -0.6335000       2.155800      -1.280600    
 O   -3.796800     -0.8528000     -0.5470000    
 O  -0.6320000       2.406300      0.9785000    
 O   -3.211700       1.058800      0.5347000    
 O    3.765300      -1.116500      7.7000000E-03
 N    2.002900      0.4485000     -7.7999998E-03
 C   0.8542000     -0.3475000      2.4300000E-02
 C  -0.4186000      0.2231000      2.3399999E-02
 C   -1.549100     -0.5934000      5.5100001E-02
 C   0.9966000      -1.734700      5.6600001E-02
 C   -1.406800      -1.980600      8.7399997E-02
 C  -0.1338000      -2.551200      8.8000000E-02
 C  -0.5691000       1.675800     -1.1000000E-02
 C   -2.894100     -3.2400001E-02  5.4499999E-02
 C    3.339700      3.3799998E-02 -1.2400000E-02
 C    4.286700       1.207000     -5.1399998E-02
 H    1.941800      -2.257400      6.0800001E-02
 H   -2.266200      -2.644900      0.1265000    
 H  -2.4100000E-02  -3.631500      0.1164000    
 H    1.847000       1.453200     -3.0500000E-02
 H    4.126600       1.780800     -0.9684000    
 H    5.320100      0.8499000     -3.1199999E-02
 H    4.117100       1.850000      0.8170000    
 H  -0.7338000       3.131500      -1.297800    
 H   -4.699300     -0.4680000     -0.5435000    


%chk=000084885-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084885

0 1
O -1.550951 2.055314 -1.132087
O -3.885325 -0.737019 -0.559612
O 0.445325 2.540440 -0.081289
O -3.199822 0.965253 0.861665
O 3.824873 -1.155246 0.006769
N 2.074605 0.426393 0.068167
C 0.928018 -0.390271 0.012276
C -0.367106 0.230442 -0.111939
C -1.540147 -0.587607 -0.072210
C 1.017633 -1.813303 0.063010
C -1.427411 -1.992426 -0.027236
C -0.147923 -2.593163 0.019547
C -0.441315 1.685627 -0.386966
C -2.905098 0.000574 0.122170
C 3.425384 0.042987 0.068785
C 4.381907 1.228887 0.152320
H 2.007467 -2.268095 0.126861
H -2.335244 -2.600060 -0.006229
H -0.062275 -3.684319 0.051643
H 1.865036 1.438955 0.133169
H 4.282298 1.879609 -0.735857
H 5.412338 0.849824 0.204235
H 4.177303 1.846203 1.046219
H -1.572729 3.045184 -1.227513
H -4.777738 -0.350586 -0.346598


