%chk=000102826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102826

0 1
 O    3.839100      0.8374000      0.5044000    
 O  -0.3880000     -0.2798000      0.1862000    
 O    4.111600     -0.8972000     -0.9760000    
 O  -0.8493000      -2.346500     -0.7870000    
 O   -6.566900      0.4793000      0.9778000    
 O   -6.324300       1.362100      -1.017400    
 N    2.160500     -0.6365000      0.2517000    
 N   -5.849500      0.8030000      6.9999998E-04
 C    5.146700       1.312800      0.1828000    
 C    5.193600       1.634000      -1.310300    
 C    5.395300       2.571400       1.011300    
 C    6.160600      0.2263000      0.5385000    
 C    1.441200      -1.783100     -0.2537000    
 C    3.433100     -0.2921000     -0.1526000    
 C    1.729200      -3.006600      0.6021000    
 C  -5.8800001E-02  -1.529700     -0.3242000    
 C   -1.758000     -8.6000003E-03  0.1394000    
 C   -2.539500     -0.3640000       1.216100    
 C   -2.272700      0.6048000     -0.9809000    
 C   -4.457100      0.5283000      4.8400000E-02
 C   -3.906900     -9.2100002E-02   1.170000    
 C   -3.639900      0.8769000      -1.027000    
 H    4.297700       2.183400      -1.622400    
 H    6.065900       2.258000      -1.539500    
 H    5.279900      0.7605000      -1.961500    
 H    5.313800       2.353700       2.082500    
 H    4.640700       3.335600      0.7926000    
 H    6.385300       2.997500      0.8191000    
 H    6.200700     -0.6076000     -0.1666000    
 H    7.174800      0.6427000      0.5618000    
 H    5.949400     -0.1979000       1.527100    
 H    1.780300      -1.962800      -1.280900    
 H    1.712500     -5.5399999E-02  0.9541000    
 H    1.215000      -3.891400      0.2122000    
 H    2.802400      -3.223700      0.6324000    
 H    1.390700      -2.855000       1.633500    
 H   -2.110400     -0.8460000       2.088900    
 H   -1.636000      0.8766000      -1.817000    
 H   -4.512600     -0.3780000       2.026200    
 H   -4.033600       1.361200      -1.917000    


%chk=000102826-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102826

0 1
O 3.784212 0.874244 0.088896
O -0.496517 -0.693944 0.195242
O 4.239874 -1.375913 -0.543130
O -0.634856 -2.898885 -0.633517
O -6.799463 0.419111 -0.269641
O -6.031023 2.428403 0.492395
N 2.135683 -0.670144 0.190181
N -5.850575 1.206597 0.113489
C 5.194782 1.382372 -0.195129
C 5.511154 1.196497 -1.692299
C 5.074065 2.869613 0.178532
C 6.195984 0.647068 0.718058
C 1.541374 -2.002234 0.072870
C 3.465852 -0.469756 -0.126656
C 1.797331 -2.890747 1.328031
C 0.038943 -1.950851 -0.195288
C -1.868308 -0.324256 0.129210
C -2.927049 -1.169372 -0.288764
C -2.103934 1.010583 0.538677
C -4.466559 0.676457 0.119469
C -4.238397 -0.653749 -0.290361
C -3.411986 1.520399 0.535795
H 4.742839 1.689936 -2.313780
H 6.488511 1.659493 -1.921085
H 5.555234 0.127978 -1.955278
H 4.784316 2.982303 1.237540
H 4.313527 3.367430 -0.447383
H 6.043474 3.375952 0.023701
H 6.249733 -0.422770 0.462179
H 7.200265 1.092343 0.595273
H 5.900918 0.750879 1.777461
H 2.006538 -2.509472 -0.792743
H 1.571723 0.111585 0.522566
H 1.360959 -3.894587 1.188444
H 2.886782 -2.991818 1.462173
H 1.364664 -2.428819 2.232597
H -2.731185 -2.193912 -0.603726
H -1.257986 1.628489 0.852011
H -5.084228 -1.270489 -0.604944
H -3.630175 2.545482 0.844737


