%chk=000186580.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186580

0 1
O -1.742150 2.441326 -1.203190
O -3.585195 2.301379 0.773306
C -1.260242 2.152730 0.117934
C -2.418139 1.492744 0.915491
C -0.041533 1.264177 0.079531
C -0.213189 -0.163394 0.046417
C -2.668821 0.076927 0.446196
C -1.582179 -0.719942 0.026896
C 1.216274 1.812536 0.070520
C 0.902543 -0.973677 0.043223
C 2.224279 -0.430257 0.044868
C 2.380444 0.980142 0.050044
C -3.968277 -0.437535 0.444425
C -1.835376 -2.029396 -0.412831
C 3.403136 -1.261018 0.038724
C 3.690804 1.552864 0.041298
C -4.204434 -1.745778 0.013350
C -3.136922 -2.538199 -0.417981
C 4.650782 -0.675069 0.031835
C 4.795681 0.740250 0.031760
C 3.273033 -2.750145 0.039355
H -1.047258 3.173295 0.516370
H -2.224458 1.512357 2.015155
H 1.353772 2.895080 0.077308
H 0.787822 -2.058726 0.042815
H -4.792554 0.197404 0.780164
H -1.014132 -2.656368 -0.758611
H -1.777505 1.619191 -1.744346
H 3.790526 2.636679 0.041525
H -3.689622 2.572220 -0.177282
H -5.217604 -2.144272 0.012964
H -3.318353 -3.556095 -0.760137
H 5.552042 -1.286123 0.026325
H 5.800463 1.161716 0.024404
H 4.246958 -3.258275 0.051725
H 2.741061 -3.106265 -0.854662
H 2.720324 -3.104182 0.921909


%chk=000186580-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186580

0 1
O -1.800425 2.451411 -1.268233
O -3.622776 2.366394 0.809437
C -1.282732 2.148803 0.103764
C -2.436409 1.514791 0.913555
C -0.054193 1.264612 0.085271
C -0.220911 -0.172861 0.054318
C -2.698555 0.082564 0.439346
C -1.600088 -0.736561 0.033277
C 1.224373 1.819887 0.089178
C 0.926462 -0.980635 0.042475
C 2.250094 -0.435354 0.043023
C 2.402191 1.006961 0.062941
C -4.013527 -0.430865 0.425328
C -1.868473 -2.067573 -0.388321
C 3.430037 -1.273320 0.030658
C 3.712955 1.583792 0.064960
C -4.261539 -1.759478 0.015725
C -3.182102 -2.578106 -0.392909
C 4.691076 -0.661634 0.032014
C 4.839110 0.760701 0.048068
C 3.311931 -2.786568 0.015325
H -1.059199 3.149223 0.507708
H -2.171127 1.514720 1.987942
H 1.336099 2.911278 0.106523
H 0.813293 -2.068731 0.057439
H -4.828550 0.230183 0.736585
H -1.049203 -2.703567 -0.740506
H -1.787976 1.613241 -1.800476
H 3.816901 2.674920 0.078731
H -3.649758 2.666052 -0.142157
H -5.284692 -2.151056 0.007939
H -3.365788 -3.605895 -0.724907
H 5.589542 -1.289961 0.021114
H 5.843746 1.197230 0.047846
H 4.308769 -3.257973 0.011042
H 2.767031 -3.145266 -0.878886
H 2.766410 -3.163059 0.901659


