%chk=000079977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079977

0 1
 O   -2.369800      -2.916600      0.3960000    
 O    7.434000     -0.1981000     -0.2731000    
 O    1.385800      0.8622000       1.294200    
 O  -0.9005000       1.787100     -0.8872000    
 O   -6.827400       1.465500      0.3840000    
 O   -5.128500       2.827100     -0.2687000    
 N   -1.193100     -0.4886000     -0.3808000    
 C   -2.571800     -0.5717000     -7.0699997E-02
 C   0.9861000      0.3315000      -1.014500    
 C   -3.123900      -1.784300      0.3092000    
 C    3.334300      0.3465000      7.9700001E-02
 C    1.897800      0.5368000      0.2035000    
 C  -0.4808000      0.6392000     -0.7671000    
 C   -3.343400      0.5762000     -0.1568000    
 C   -4.703600      0.5093000      0.1452000    
 C   -4.484100      -1.851000      0.6113000    
 C   -5.273900     -0.7042000      0.5291000    
 C    3.885700     -2.3000000E-02  -1.147000    
 C    4.160600      0.5335000       1.187900    
 C    6.089900     -1.8700000E-02 -0.1575000    
 C    5.263600     -0.2057000      -1.265600    
 C    5.538400      0.3509000       1.069300    
 C   -5.527400       1.704800      5.9099998E-02
 C   -2.268200      -3.718300     -0.7787000    
 C    8.220100      9.6000005E-03  0.8994000    
 H    1.313600      0.9998000      -1.819500    
 H    1.084900     -0.7042000      -1.359300    
 H  -0.6814000      -1.364000     -0.2967000    
 H   -2.962400       1.541500     -0.4521000    
 H   -4.934800      -2.793100      0.9120000    
 H   -6.328100     -0.8012000      0.7731000    
 H    3.282100     -0.1812000      -2.035000    
 H    3.754100      0.8215000       2.153900    
 H    5.688000     -0.4943000      -2.223500    
 H    6.121700      0.5123000       1.969400    
 H   -1.601400      -4.557700     -0.5636000    
 H   -3.250300      -4.114100      -1.056100    
 H   -1.848300      -3.142600      -1.609500    
 H    7.964500     -0.7069000       1.687400    
 H    8.159700       1.046900       1.245900    
 H    9.264000     -0.1756000      0.6256000    
 H   -7.374400       2.277600      0.3224000    


%chk=000079977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079977

0 1
O -1.876987 -2.255627 0.790053
O 7.545658 0.388748 -0.077325
O 1.270162 -1.025605 0.338830
O -1.099242 2.169804 -1.258945
O -7.235724 0.854974 -0.865013
O -5.680163 2.435379 -1.550466
N -1.141315 0.040922 -0.259925
C -2.535773 -0.196244 -0.200659
C 1.034904 1.181885 -0.712536
C -2.939541 -1.448970 0.371962
C 3.324098 0.126559 -0.122408
C 1.839167 0.015857 -0.129955
C -0.508747 1.161495 -0.762215
C -3.531309 0.694639 -0.654761
C -4.904267 0.344911 -0.541188
C -4.303638 -1.792050 0.482648
C -5.288494 -0.894184 0.025404
C 4.022785 1.261028 -0.633424
C 4.081873 -0.947555 0.418549
C 6.161949 0.231634 -0.058023
C 5.422509 1.315586 -0.603192
C 5.485850 -0.908164 0.456817
C -5.910603 1.315214 -1.033058
C -2.181478 -3.554218 1.394755
C 8.374713 -0.692525 0.472797
H 1.304072 2.109409 -0.169797
H 1.365485 1.360426 -1.754789
H -0.514535 -0.701567 0.113366
H -3.244005 1.652422 -1.093224
H -4.602278 -2.748760 0.920375
H -6.349458 -1.143817 0.102861
H 3.474783 2.107981 -1.058108
H 3.536498 -1.813518 0.807949
H 5.971290 2.178374 -0.991478
H 6.040500 -1.750567 0.880080
H -1.202679 -3.988910 1.642354
H -2.783821 -3.431771 2.314911
H -2.715286 -4.209282 0.680266
H 8.222860 -1.634887 -0.086553
H 8.159878 -0.852108 1.546294
H 9.410547 -0.347075 0.347140
H -7.848839 1.554857 -1.215769


