%chk=000146729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146729

0 1
 O   -3.079700     -0.2795000      0.4559000    
 O   -1.464900      -4.716400      0.4304000    
 C   -1.596900       1.669200      0.2870000    
 C  -0.4746000      0.8315000     -0.3595000    
 C   -2.990900       1.074300     -3.7200000E-02
 C   -1.423700       3.153100     -8.7200001E-02
 C   0.8953000       1.310400      0.1766000    
 C  -0.7343000     -0.6444000     -0.1471000    
 C   -2.003000      -1.097300      0.2403000    
 C    1.042100       2.812400      0.2187000    
 C  -1.1200000E-02   3.633800      7.5599998E-02
 C   -3.187100      0.9522000      -1.558500    
 C   -4.182500       1.874000      0.5173000    
 C   0.2692000      -1.599500     -0.3799000    
 C    1.617400      -1.289200     -0.9456000    
 C   -2.240600      -2.460900      0.4486000    
 C    2.431700       3.338600      0.4287000    
 C   2.7100001E-02  -2.960700     -0.1837000    
 C   -1.226200      -3.390900      0.2381000    
 C    2.711100      -1.063900      0.1126000    
 C    4.062000     -0.6815000     -0.5000000    
 C    5.113300     -0.4415000      0.5843000    
 C    6.446500     -2.3900000E-02 -1.5400000E-02
 H   -1.476300       1.590000       1.380100    
 H  -0.4763000       1.007700      -1.444800    
 H   -2.068600       3.763400      0.5557000    
 H   -1.726800       3.343600      -1.121900    
 H    1.698400       1.027600     -0.4912000    
 H    1.046700      0.9477000       1.198000    
 H   0.1359000       4.710500      8.7499999E-02
 H   -4.165000      0.5013000      -1.773400    
 H   -3.168300       1.927600      -2.054200    
 H   -2.466800      0.3024000      -2.062700    
 H   -4.256000       2.869900      7.0200004E-02
 H   -5.125700       1.343800      0.3426000    
 H   -4.087500       1.985700       1.603100    
 H    1.941300      -2.136700      -1.569800    
 H    1.556700     -0.4859000      -1.687700    
 H   -3.225000      -2.799000      0.7648000    
 H    2.844800       2.951800       1.366000    
 H    2.456500       4.432200      0.4800000    
 H    3.085600       3.028500     -0.3928000    
 H   0.8091000      -3.694300     -0.3677000    
 H    2.853700      -2.022400      0.6340000    
 H    2.452800     -0.3836000      0.9196000    
 H    4.399600      -1.476400      -1.175800    
 H    3.945900      0.2279000      -1.101500    
 H    5.252700      -1.353400       1.176300    
 H    4.769500      0.3419000       1.269900    
 H  -0.6529000      -5.215300      0.2363000    
 H    6.346300      0.9055000     -0.5852000    
 H    7.183400      0.1411000      0.7767000    
 H    6.834800     -0.7978000     -0.6852000    


%chk=000146729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146729

0 1
O -3.089081 -0.215296 0.505878
O -1.358936 -4.645934 0.799710
C -1.755916 1.799990 0.160893
C -0.488339 0.988052 -0.240524
C -3.070063 1.093093 -0.246193
C -1.621399 3.254002 -0.342238
C 0.682800 1.575187 0.601404
C -0.681394 -0.523915 -0.064706
C -1.948066 -1.027705 0.368309
C 0.773191 3.094836 0.490918
C -0.268226 3.838697 0.026380
C -3.193232 0.793004 -1.754989
C -4.317200 1.813670 0.285208
C 0.345114 -1.483011 -0.327915
C 1.689606 -1.119810 -0.958681
C -2.161133 -2.388166 0.671295
C 2.089630 3.716832 0.915089
C 0.126533 -2.855321 -0.047080
C -1.106190 -3.295977 0.483383
C 2.900260 -1.253398 0.007061
C 4.232004 -0.809216 -0.636610
C 5.448582 -0.985250 0.300976
C 6.774998 -0.519916 -0.337553
H -1.778688 1.833217 1.271380
H -0.265713 1.208887 -1.308116
H -2.418575 3.883357 0.100863
H -1.769757 3.302411 -1.442707
H 1.650060 1.145944 0.286310
H 0.553491 1.274864 1.662998
H -0.151915 4.927678 -0.071301
H -4.137744 0.257020 -1.952563
H -3.198690 1.729668 -2.340924
H -2.360802 0.163872 -2.113279
H -4.505667 2.746505 -0.274242
H -5.198179 1.158024 0.174639
H -4.202036 2.057419 1.356041
H 1.868272 -1.797378 -1.818616
H 1.667438 -0.098121 -1.378795
H -3.141173 -2.727877 1.013459
H 2.331974 3.455888 1.964982
H 2.069343 4.817733 0.834493
H 2.929653 3.341529 0.296394
H 0.924696 -3.579284 -0.262244
H 2.983810 -2.307291 0.341178
H 2.712473 -0.659203 0.923329
H 4.402793 -1.385311 -1.570642
H 4.156885 0.256588 -0.941041
H 5.530832 -2.052222 0.592921
H 5.269716 -0.420524 1.238752
H -0.557628 -5.197568 0.620664
H 6.730020 0.551984 -0.608384
H 7.627564 -0.658028 0.352594
H 6.992603 -1.089030 -1.261257


