%chk=000207442.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207442

0 1
O -0.498044 0.185366 -0.192017
O -5.729239 -0.672139 0.615588
O -2.023638 -1.204905 -1.989445
O 3.866934 -1.145325 1.108081
N -1.886989 0.425539 -0.296588
N -3.873960 -0.944479 -0.663966
C -2.351479 0.631059 1.113153
C -3.870376 0.790584 1.117580
C -4.595715 -0.314649 0.388709
C 0.188489 0.776567 -1.359234
C -2.524081 -0.657264 -1.034113
C 1.636897 0.790953 -0.959103
C 2.138913 -0.180145 -0.096680
C 2.482767 1.785898 -1.486885
C 3.507979 -0.138223 0.241114
C 3.833948 1.796994 -1.144213
C 4.367897 0.838453 -0.274211
C 5.254831 -1.228930 1.512612
H -1.852241 1.555857 1.489031
H -2.027034 -0.197897 1.782917
H -4.162490 1.761354 0.650332
H -4.246946 0.849714 2.163447
H -0.221399 1.780874 -1.560863
H -0.001868 0.106410 -2.223860
H -4.364470 -1.658751 -1.223945
H 1.500640 -0.960597 0.317275
H 2.086551 2.540467 -2.160437
H 4.489607 2.564678 -1.556911
H 5.420214 0.864977 -0.017481
H 5.546115 -0.328143 2.059952
H 5.894550 -1.404988 0.643142
H 5.242037 -2.105008 2.174522


%chk=000207442-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207442

0 1
O -0.537538 0.543486 0.244762
O -5.931531 -0.729675 0.294951
O -1.519854 -1.899139 -0.660831
O 4.225462 -1.549092 0.458121
N -1.958069 0.325860 0.000549
N -3.705458 -1.267082 -0.104985
C -2.802688 1.184468 0.857045
C -4.263786 1.085363 0.379115
C -4.732003 -0.358981 0.208446
C 0.182391 0.752763 -1.069654
C -2.310442 -1.003415 -0.264458
C 1.651464 0.808930 -0.732576
C 2.303582 -0.363617 -0.293308
C 2.379810 2.021182 -0.852088
C 3.681181 -0.329218 0.029167
C 3.754279 2.045270 -0.537238
C 4.417055 0.877265 -0.094719
C 5.647564 -1.573645 0.806599
H -2.431392 2.217397 0.763858
H -2.709451 0.880882 1.920166
H -4.381026 1.591077 -0.598749
H -4.941511 1.581871 1.092033
H -0.180170 1.692470 -1.526066
H -0.062104 -0.109119 -1.714526
H -3.978780 -2.236115 -0.300728
H 1.752817 -1.304056 -0.189514
H 1.873920 2.933586 -1.187526
H 4.321081 2.978049 -0.632711
H 5.483581 0.917358 0.145810
H 5.869644 -0.885486 1.645616
H 6.281811 -1.314286 -0.063795
H 5.848560 -2.610052 1.114735


