%chk=000287598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287598

0 1
O -4.848774 1.308213 -0.818871
O -2.139740 -1.154977 2.151113
O 5.662850 0.236110 0.004563
C -0.709163 0.670951 0.586991
C -2.239597 0.535916 0.428481
C -2.655038 0.239475 -1.028120
C 0.039929 -0.535423 -0.029878
C -1.921787 -0.996655 -1.575945
C -0.404355 -0.808386 -1.482991
C -0.196164 1.989840 -0.014685
C -4.187452 0.065212 -1.144399
C -2.810684 -0.527550 1.363502
C 1.538131 -0.334025 0.007448
C -4.777736 -0.949845 -0.157416
C 1.285965 2.186215 0.321081
C -4.312592 -0.712114 1.278529
C 2.118848 0.947319 0.131917
C 2.369653 -1.456209 -0.101134
C 3.509989 1.087133 0.124892
C 3.762356 -1.339955 -0.107776
C 4.314757 -0.059012 0.001721
C 6.594666 -0.866607 -0.093776
H -0.484504 0.671125 1.686839
H -2.718294 1.506982 0.727012
H -2.359866 1.124011 -1.646766
H -0.221246 -1.430264 0.597132
H -2.212950 -1.181527 -2.626600
H -2.220302 -1.901381 -1.010396
H 0.110723 -1.708988 -1.867154
H -0.077809 0.023903 -2.135789
H -0.781235 2.846571 0.366751
H -0.333711 1.985460 -1.113242
H -4.470559 -0.197187 -2.189653
H -4.513649 -1.975345 -0.481918
H -5.885985 -0.882518 -0.196655
H 1.390431 2.513345 1.379572
H 1.696084 3.018302 -0.287617
H -4.630627 -1.547335 1.934249
H -4.807532 0.198557 1.682731
H 1.925257 -2.449437 -0.180887
H -4.549619 2.024381 -1.407521
H 3.986142 2.059762 0.217087
H 4.380919 -2.224727 -0.192210
H 7.561493 -0.348077 -0.060455
H 6.463625 -1.391287 -1.044261
H 6.480752 -1.538151 0.762006


%chk=000287598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287598

0 1
O -4.909474 1.341862 -0.844485
O -2.199157 -1.105569 2.267403
O 5.771865 0.255442 0.007846
C -0.727683 0.675154 0.581013
C -2.262324 0.527812 0.424332
C -2.699810 0.199439 -1.041359
C 0.043247 -0.532568 -0.027695
C -1.947640 -1.047663 -1.567782
C -0.419884 -0.840770 -1.484778
C -0.192822 2.005950 -0.002561
C -4.236945 0.058859 -1.158459
C -2.879518 -0.485459 1.404589
C 1.557793 -0.320491 0.018784
C -4.823820 -0.963762 -0.173636
C 1.281102 2.210302 0.406763
C -4.389812 -0.664739 1.286803
C 2.143052 0.971354 0.173960
C 2.418948 -1.433853 -0.126750
C 3.548761 1.106647 0.159772
C 3.824604 -1.308628 -0.135342
C 4.390549 -0.017580 0.004735
C 6.680399 -0.881212 -0.144010
H -0.514347 0.679369 1.669826
H -2.745342 1.497435 0.683534
H -2.394432 1.058802 -1.679161
H -0.203329 -1.421389 0.587736
H -2.247978 -1.252822 -2.615119
H -2.225733 -1.940959 -0.972110
H 0.107540 -1.742959 -1.848390
H -0.117238 -0.013342 -2.157852
H -0.800380 2.854457 0.370151
H -0.275096 2.010784 -1.107395
H -4.489438 -0.243916 -2.199177
H -4.499359 -1.978854 -0.468540
H -5.925437 -0.936123 -0.248703
H 1.316849 2.464102 1.487094
H 1.717473 3.075609 -0.128260
H -4.715320 -1.460561 1.977986
H -4.870977 0.285432 1.593491
H 1.978115 -2.434172 -0.227028
H -4.590202 2.031578 -1.479995
H 4.015787 2.091149 0.276583
H 4.450712 -2.199128 -0.244061
H 7.691203 -0.447868 -0.115603
H 6.523780 -1.398209 -1.111302
H 6.563315 -1.607143 0.684652


