%chk=000156199.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156199

0 1
 O    1.023500       1.281200     -0.2972000    
 O  -0.8002000      -1.937500     -0.3393000    
 O    4.326100      -2.226700      0.1970000    
 O    5.604900       2.356200      0.2087000    
 O   -3.428100       2.240600       2.166800    
 O   -5.052800       2.684000     -4.4599999E-02
 N   -4.190800      -3.078700      0.3083000    
 C   0.1774000      -1.001200      0.1022000    
 C   4.7699999E-02  0.3045000     -0.6947000    
 C    1.564400      -1.596000     -0.1261000    
 C    2.625300     -0.5413000     -3.7799999E-02
 C    2.301500      0.8161000     -0.1390000    
 C   -1.317600      0.9427000     -0.5171000    
 C    3.967200     -0.9129000      0.1204000    
 C    3.301400       1.787900     -4.4100001E-02
 C   -1.754500       1.303900      0.7555000    
 C   -2.129700       1.164000      -1.627100    
 C  -0.7033000      -3.162800      0.3719000    
 C    4.965500      5.8100000E-02  0.2029000    
 C    4.632100       1.408200      0.1246000    
 C   -3.009800       1.889500      0.9187000    
 C   -3.385000       1.749600      -1.463900    
 C   -1.803000      -4.109300     -8.8600002E-02
 C   -3.825100       2.112400     -0.1909000    
 C   -3.137200      -3.532300      0.1336000    
 H   4.5800000E-02 -0.8059000       1.175300    
 H   0.1974000      9.6500002E-02  -1.763900    
 H    1.623400      -2.085200      -1.106800    
 H    1.772300      -2.352700      0.6395000    
 H    3.037000       2.840900     -0.1086000    
 H   -1.118900       1.143200       1.622500    
 H   -1.801000      0.8861000      -2.624700    
 H   0.2438000      -3.671000      0.1686000    
 H  -0.7904000      -2.977500       1.449600    
 H    6.006200     -0.2302000      0.3293000    
 H   -4.010000       1.917500      -2.337000    
 H   -1.715600      -5.064300      0.4407000    
 H   -1.685100      -4.311500      -1.159800    
 H    5.290600      -2.288900      0.3048000    
 H    5.195900       3.235500      0.1346000    
 H   -2.735500       2.011300       2.810000    
 H   -5.473100       2.759800     -0.9184000    


%chk=000156199-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156199

0 1
O 1.136071 1.177594 -0.083488
O -0.447270 -2.243126 -0.389673
O 4.672114 -2.157773 -0.145486
O 5.777576 2.546036 0.336867
O -3.174674 2.644128 2.174750
O -5.163236 2.013662 0.447956
N -3.697830 -2.739967 -2.353290
C 0.476329 -1.205263 0.100209
C 0.182111 0.154775 -0.604906
C 1.894821 -1.679438 -0.248228
C 2.900950 -0.549403 -0.125684
C 2.493015 0.803102 -0.041797
C -1.212837 0.690964 -0.373663
C 4.294047 -0.803830 -0.058853
C 3.414157 1.864509 0.115418
C -1.514077 1.443200 0.789395
C -2.247790 0.392278 -1.286568
C -1.571198 -2.543389 0.502643
C 5.246063 0.224588 0.095259
C 4.788622 1.558221 0.184690
C -2.828218 1.885204 1.046594
C -3.569902 0.814396 -1.023864
C -2.408505 -3.632369 -0.196779
C -3.874144 1.560741 0.135539
C -3.114316 -3.144040 -1.394671
H 0.359758 -1.061295 1.196036
H 0.370294 0.019603 -1.689362
H 1.876757 -2.080391 -1.280936
H 2.188356 -2.523194 0.400349
H 3.039050 2.892187 0.166973
H -0.702070 1.709233 1.477777
H -2.040153 -0.193697 -2.186926
H -1.195181 -2.946357 1.467418
H -2.180698 -1.641706 0.701501
H 6.321340 0.024088 0.144916
H -4.368945 0.553914 -1.729455
H -3.154961 -4.034016 0.514627
H -1.739466 -4.463340 -0.487301
H 5.654389 -2.250797 -0.076816
H 5.369413 3.445795 0.380247
H -2.368043 2.833540 2.716397
H -5.799022 1.745435 -0.261917


