%chk=000181719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181719

0 1
O -4.333031 -1.147479 -1.334595
O -4.400052 1.326190 -0.531049
C -1.590305 -0.650750 0.286850
C -3.958019 -1.046067 0.043385
C -3.713082 0.472225 0.365893
C -2.611492 -1.757243 0.315148
C -2.205065 0.603934 0.293869
C -0.186822 -0.758928 0.250802
C 0.604418 0.423642 0.136574
C -1.443708 1.770148 0.301480
C -0.048154 1.689016 0.254374
C 2.044370 0.249105 -0.078302
C 0.444081 -2.056527 0.384640
C 2.630680 -1.026983 0.125422
C 1.791475 -2.178603 0.382407
C 0.694731 2.977797 0.410519
C 2.897395 1.283555 -0.544058
C 4.034128 -1.201481 0.014563
C 4.262180 1.097478 -0.673538
C 4.845387 -0.148739 -0.363198
H -4.826220 -1.476812 0.574855
H -4.100859 0.768175 1.365960
H -2.412455 -2.539929 -0.439713
H -2.619178 -2.270291 1.294967
H -1.948215 2.735853 0.349281
H -0.200596 -2.924180 0.518444
H -3.544061 -1.062873 -1.916938
H -4.552046 0.868071 -1.401176
H 2.277412 -3.141383 0.537958
H 0.035862 3.813648 0.683215
H 1.454962 2.903030 1.203974
H 1.209006 3.269592 -0.520475
H 2.470868 2.243784 -0.845044
H 4.463937 -2.181014 0.220334
H 4.895519 1.910723 -1.024833
H 5.923250 -0.275384 -0.442193


%chk=000181719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181719

0 1
O -4.218940 -1.093516 -1.383627
O -4.574122 1.353360 -0.267009
C -1.606446 -0.661419 0.316043
C -3.967614 -1.063216 0.079441
C -3.748947 0.431719 0.503456
C -2.641118 -1.781722 0.442794
C -2.239289 0.586135 0.337023
C -0.189050 -0.757661 0.212598
C 0.623994 0.448365 0.095395
C -1.475360 1.765738 0.244254
C -0.067717 1.729923 0.120790
C 2.088449 0.264401 -0.033918
C 0.419289 -2.067903 0.234134
C 2.643845 -1.077423 -0.001246
C 1.782904 -2.224734 0.139236
C 0.594033 3.099913 0.039054
C 3.041000 1.324960 -0.202896
C 4.052138 -1.293119 -0.113911
C 4.419896 1.092066 -0.315731
C 4.942652 -0.227347 -0.267623
H -4.867957 -1.514345 0.520823
H -4.045042 0.582908 1.559101
H -2.464583 -2.651313 -0.216690
H -2.686291 -2.167773 1.481065
H -1.990126 2.732643 0.256737
H -0.230314 -2.943154 0.338843
H -3.347521 -1.006746 -1.852702
H -4.715162 0.912589 -1.152265
H 2.238740 -3.221351 0.164184
H -0.174324 3.885178 0.134493
H 1.328633 3.263663 0.848838
H 1.106083 3.266538 -0.927119
H 2.714228 2.357908 -0.256565
H 4.423181 -2.324485 -0.079679
H 5.097074 1.943935 -0.444036
H 6.020086 -0.403415 -0.353484


