%chk=000042027.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042027

0 1
 O    5.548300      0.6185000     -1.9999999E-04
 C   1.8300001E-02 -0.2507000     -9.9999997E-05
 C    1.425100     -3.2699998E-02   0.000000    
 C  -0.8911000      0.8405000     -9.9999997E-05
 C  -0.4650000      -1.577100     -9.9999997E-05
 C   -2.306200      0.5832000     -9.9999997E-05
 C    1.940100       1.281500       0.000000    
 C    2.322500      -1.128400      9.9999997E-05
 C   -2.763500     -0.7579000     -1.9999999E-04
 C   -1.842900      -1.810900     -3.0000001E-04
 C  -0.3294000       2.137800       0.000000    
 C   0.4365000      -2.650100      1.9999999E-04
 C    1.050800       2.355500       0.000000    
 C    1.812400      -2.429600      1.9999999E-04
 C    3.327900       1.487500      9.9999997E-05
 C    3.705500     -0.8948000      1.9999999E-04
 C   -3.301000       1.594100      9.9999997E-05
 C    4.204100      0.4054000      9.9999997E-05
 C   -4.140100      -1.044100     -9.9999997E-05
 C   -4.666300       1.296400      3.0000001E-04
 C   -5.086200     -2.4100000E-02  9.9999997E-05
 H   -2.207300      -2.838800     -1.9999999E-04
 H  -0.9594000       3.023700       0.000000    
 H   7.5199999E-02  -3.676800      3.0000001E-04
 H    1.417200       3.380200      9.9999997E-05
 H    2.480000      -3.288700      3.0000001E-04
 H    3.732900       2.497900       0.000000    
 H    4.397700      -1.735000      1.9999999E-04
 H   -3.032500       2.647400      3.0000001E-04
 H   -4.490600      -2.074800     -1.9999999E-04
 H   -5.396300       2.100600      5.0000002E-04
 H   -6.145500     -0.2619000      3.0000001E-04
 H    6.004700     -0.2404000     -1.9999999E-04


%chk=000042027-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042027

0 1
O 5.619199 0.705767 0.000008
C 0.014602 -0.273931 0.000043
C 1.435373 -0.047212 0.000042
C -0.900340 0.832442 0.000050
C -0.488420 -1.639496 0.000035
C -2.332942 0.582309 0.000058
C 1.959355 1.297224 0.000042
C 2.356795 -1.159343 0.000031
C -2.809579 -0.789080 0.000056
C -1.873048 -1.865876 0.000037
C -0.347259 2.165619 0.000059
C 0.462261 -2.735457 0.000031
C 1.020484 2.391446 0.000049
C 1.822444 -2.508839 0.000023
C 3.364083 1.512784 0.000037
C 3.750705 -0.912998 0.000018
C -3.310631 1.630363 0.000080
C 4.243440 0.415789 0.000030
C -4.222285 -1.047010 0.000067
C -4.680705 1.350880 0.000099
C -5.144977 -0.001507 0.000082
H -2.251152 -2.896147 0.000033
H -1.020092 3.028130 0.000067
H 0.070140 -3.759495 0.000025
H 1.409533 3.416232 0.000049
H 2.526459 -3.349461 0.000015
H 3.775022 2.526795 0.000040
H 4.447655 -1.762334 0.000003
H -2.988603 2.675987 0.000095
H -4.563854 -2.089110 0.000065
H -5.404644 2.173338 0.000122
H -6.220355 -0.209931 0.000090
H 6.157237 -0.124478 0.000016


