%chk=000229385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229385

0 1
O -4.179538 -0.373021 1.000754
O -4.451653 -0.674405 -1.225269
C 2.070276 -0.622705 0.397602
C 3.202421 0.284529 -0.102868
C 0.697553 0.033700 0.198224
C 4.575855 -0.370652 0.096378
C -0.434759 -0.873751 0.698119
C 5.707631 0.536521 -0.404349
C -1.803208 -0.213025 0.500404
C 7.082388 -0.117180 -0.205153
C -2.926774 -1.123414 0.986766
C 8.212681 0.781366 -0.702341
C -4.858123 -0.208722 -0.188358
C -6.111240 0.578121 0.091235
C -6.327655 1.641534 -0.976503
H 2.223563 -0.859271 1.468156
H 2.104295 -1.593521 -0.133753
H 3.168868 1.256093 0.426809
H 3.050270 0.520252 -1.173954
H 0.664088 1.005419 0.727793
H 0.545123 0.269335 -0.873248
H 4.609797 -1.341868 -0.433996
H 4.728578 -0.606594 1.167140
H -0.279202 -1.112582 1.768213
H -0.402513 -1.842238 0.160857
H 5.674906 1.508528 0.124188
H 5.556833 0.772609 -1.475278
H -1.963731 0.030394 -0.571096
H -1.849251 0.755294 1.036925
H 7.117194 -1.088995 -0.735413
H 7.235718 -0.351927 0.866344
H -3.053087 -2.018794 0.353764
H -2.832935 -1.404516 2.050702
H 8.230570 1.739276 -0.170294
H 8.111924 1.002618 -1.770974
H 9.189322 0.306670 -0.556368
H -6.969044 -0.129463 0.120383
H -6.063563 1.036278 1.103670
H -5.548727 2.413874 -0.945623
H -6.311967 1.204938 -1.986412
H -7.294783 2.141497 -0.845875


%chk=000229385-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229385

0 1
O -4.241877 -0.233613 1.062859
O -4.547849 -0.478949 -1.239292
C 2.122023 -0.606049 0.332903
C 3.311522 0.307265 -0.039591
C 0.757949 0.117875 0.283839
C 4.679245 -0.408484 0.031821
C -0.432556 -0.799323 0.644143
C 5.868686 0.502656 -0.346302
C -1.787914 -0.054425 0.623193
C 7.237325 -0.211488 -0.266346
C -2.954230 -0.988596 0.970757
C 8.420033 0.705815 -0.645511
C -4.947977 -0.051072 -0.131992
C -6.247475 0.694947 0.132816
C -6.859150 1.298131 -1.145313
H 2.281747 -1.017940 1.351557
H 2.100349 -1.477706 -0.354456
H 3.323863 1.187400 0.637343
H 3.159876 0.706709 -1.064233
H 0.777726 0.982981 0.979309
H 0.600695 0.538144 -0.731082
H 4.666433 -1.291732 -0.641047
H 4.832568 -0.803275 1.058247
H -0.264581 -1.237579 1.650365
H -0.465096 -1.650248 -0.067719
H 5.880104 1.389012 0.322618
H 5.720232 0.893201 -1.374992
H -1.959578 0.380587 -0.379453
H -1.764978 0.782074 1.348711
H 7.225454 -1.096720 -0.934886
H 7.384678 -0.601505 0.761653
H -3.064379 -1.785105 0.212153
H -2.837776 -1.430618 1.974555
H 8.474615 1.581473 0.028877
H 8.310495 1.086320 -1.678748
H 9.385614 0.170791 -0.583063
H -6.951067 -0.027205 0.593767
H -6.057545 1.464704 0.902083
H -6.201023 2.074305 -1.573416
H -6.999885 0.521402 -1.915677
H -7.838195 1.758040 -0.923151


