%chk=000044285.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044285

0 1
 O    4.938300      -1.789800      3.9999999E-04
 C   0.2033000     -0.4298000      9.9999997E-05
 C  -0.7519000      0.6286000      9.9999997E-05
 C    1.619800     -0.1441000      9.9999997E-05
 C   -2.168400      0.3430000      1.9999999E-04
 C    2.054100       1.202900     -3.0000001E-04
 C   -2.603000      -1.004100     -3.0000001E-04
 C  -0.2501000       1.945900       0.000000    
 C  -0.2986000      -1.747200       0.000000    
 C    1.114200       2.228000     -3.9999999E-04
 C   -1.662900      -2.029300     -3.9999999E-04
 C    2.641600      -1.130400      3.0000001E-04
 C   -3.190300       1.329300      6.9999998E-04
 C    3.423400       1.523100     -3.9999999E-04
 C   -3.972200      -1.324100     -3.9999999E-04
 C    4.001100     -0.8030000      1.9999999E-04
 C    4.392300      0.5258000     -1.9999999E-04
 C   -4.549700       1.002000      3.9999999E-04
 C   -4.941000     -0.3268000     -9.9999997E-05
 H  -0.9153000       2.805500       0.000000    
 H   0.3661000      -2.607100     -9.9999997E-05
 H    1.426600       3.270800     -6.0000003E-04
 H   -1.975400      -3.072000     -6.0000003E-04
 H    2.394300      -2.189200      6.9999998E-04
 H   -2.949900       2.389200      1.1000000E-03
 H    3.748700       2.562000     -5.0000002E-04
 H   -4.297600      -2.363000     -7.9999998E-04
 H    5.443200      0.8006000     -3.0000001E-04
 H   -5.296800       1.790300      6.0000003E-04
 H   -5.994700     -0.5880000     -3.0000001E-04
 H    5.822700      -1.385100      3.0000001E-04


%chk=000044285-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044285

0 1
O 4.914921 -1.875945 -0.000012
C 0.204659 -0.425054 -0.000048
C -0.753233 0.644085 -0.000017
C 1.637220 -0.123667 -0.000033
C -2.184480 0.339421 0.000011
C 2.063876 1.257436 -0.000021
C -2.614283 -1.039704 -0.000044
C -0.278052 2.006522 -0.000011
C -0.271274 -1.786075 -0.000106
C 1.074667 2.301031 -0.000021
C -1.623076 -2.083397 -0.000113
C 2.638503 -1.140538 -0.000030
C -3.196903 1.352272 0.000091
C 3.459651 1.563213 -0.000012
C -4.010162 -1.352290 -0.000031
C 3.998721 -0.808663 -0.000018
C 4.424746 0.554177 -0.000013
C -4.558445 1.024709 0.000090
C -4.973760 -0.339609 0.000028
H -0.996110 2.830747 -0.000020
H 0.448211 -2.609429 -0.000159
H 1.412876 3.344189 -0.000037
H -1.959923 -3.126880 -0.000178
H 2.382261 -2.202250 -0.000029
H -2.915693 2.409383 0.000143
H 3.769230 2.614725 -0.000015
H -4.312532 -2.406467 -0.000084
H 5.494338 0.801236 -0.000013
H -5.309871 1.822183 0.000150
H -6.040701 -0.587903 0.000021
H 5.846516 -1.543456 0.000032


