%chk=000198199.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198199

0 1
O 4.124147 -2.242489 -0.047373
C 0.131618 -0.592666 -0.017775
C -0.004861 0.840894 -0.007252
C -1.070148 -1.438046 -0.018083
C -1.348946 1.438049 0.002601
C -2.354943 -0.848948 -0.008523
C -2.496435 0.613369 0.001711
C 1.402583 -1.146324 -0.027401
C 1.132232 1.633618 -0.006749
C 2.567040 -0.341189 -0.026968
C 2.438236 1.073980 -0.016446
C -0.962718 -2.846681 -0.027774
C -1.512702 2.841171 0.012908
C -3.493180 -1.685212 -0.008867
C -3.774027 1.216141 0.010830
C 3.901636 -0.886581 -0.036762
C 3.614460 1.893054 -0.015895
C -2.093163 -3.653552 -0.028017
C -2.776335 3.417000 0.021916
C -3.368864 -3.068315 -0.018464
C -3.916052 2.597479 0.020785
C 5.025440 -0.089948 -0.036140
C 4.862755 1.322464 -0.025440
H 1.528243 -2.233728 -0.035623
H 1.042108 2.722745 0.001240
H 0.024615 -3.310271 -0.035185
H -0.629307 3.483765 0.013789
H -4.488466 -1.235161 -0.001438
H -4.664723 0.584228 0.010036
H 3.495075 2.973901 -0.007763
H -1.993824 -4.737858 -0.035583
H -2.886385 4.500145 0.029835
H -4.255909 -3.699643 -0.018588
H -4.907753 3.047362 0.027706
H 6.018248 -0.532791 -0.043698
H 5.759718 1.943266 -0.025013
H 3.276988 -2.759130 -0.047237


%chk=000198199-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198199

0 1
O 4.188430 -2.289507 -0.047546
C 0.132609 -0.598994 -0.017909
C -0.007694 0.847915 -0.007344
C -1.076174 -1.452782 -0.018248
C -1.357277 1.453336 0.002607
C -2.381030 -0.854442 -0.008445
C -2.523336 0.617662 0.001982
C 1.430797 -1.148591 -0.027499
C 1.157592 1.638017 -0.006999
C 2.609554 -0.352586 -0.027206
C 2.469697 1.088730 -0.016530
C -0.980424 -2.877306 -0.028148
C -1.531146 2.869826 0.012912
C -3.525175 -1.707665 -0.008950
C -3.809093 1.237371 0.011577
C 3.947435 -0.908033 -0.036931
C 3.639082 1.922619 -0.015871
C -2.117847 -3.697036 -0.028459
C -2.803900 3.458173 0.022269
C -3.406787 -3.104690 -0.018735
C -3.957139 2.631756 0.021574
C 5.068499 -0.077195 -0.036102
C 4.907808 1.343997 -0.025494
H 1.528930 -2.240087 -0.035377
H 1.083748 2.729405 0.000727
H -0.000216 -3.361226 -0.035768
H -0.657622 3.526964 0.013616
H -4.528461 -1.274225 -0.001572
H -4.712087 0.621609 0.011263
H 3.516907 3.011354 -0.007816
H -2.010532 -4.787151 -0.036111
H -2.905386 4.548824 0.030009
H -4.304014 -3.733013 -0.018816
H -4.957318 3.078376 0.028756
H 6.063929 -0.529972 -0.043614
H 5.804040 1.973625 -0.025071
H 3.350001 -2.810958 -0.047430


