%chk=000103650.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103650

0 1
 O   -1.107900       2.820700     -2.9300001E-02
 O    3.697400      -1.569400      0.9109000    
 O    4.856600      0.1470000     -0.3211000    
 N  -0.6577000      0.4802000      7.4500002E-02
 N   -3.832700       2.162500      0.3775000    
 C   -1.480900     -0.6975000      0.2814000    
 C   -1.533000      -1.667600     -0.9080000    
 C   -2.839900     -8.7200001E-02  0.4452000    
 C   -3.999600      -1.012500      0.6183000    
 C   -2.655000      -2.698400     -0.7312000    
 C   -4.019000      -2.030700     -0.5243000    
 C   -2.844600       1.242900      0.3304000    
 C   -1.435400       1.650200      8.8699996E-02
 C   0.7651000      0.4247000     -4.6900000E-02
 C    1.476300     -0.6237000      0.5477000    
 C    1.446600       1.425900     -0.7660000    
 C    2.848400     -0.6350000      0.4028000    
 C    2.836900       1.390800     -0.8979000    
 C    3.510500      0.3452000     -0.3006000    
 C    4.967900      -1.067900      0.4479000    
 H   -1.195900      -1.201000       1.212300    
 H  -0.5739000      -2.187500      -1.013100    
 H   -1.689700      -1.117400      -1.845600    
 H   -3.901400      -1.534100       1.577800    
 H   -4.951400     -0.4714000      0.6427000    
 H   -2.428400      -3.337100      0.1315000    
 H   -2.696000      -3.350600      -1.610800    
 H   -4.777000      -2.796200     -0.3225000    
 H   -4.315100      -1.528300      -1.454300    
 H   -4.789400       1.872400      0.5340000    
 H   -3.615900       3.143400      0.2531000    
 H   0.9943000      -1.410100       1.116600    
 H   0.9130000       2.231900      -1.261200    
 H    3.361900       2.157200      -1.456500    
 H    5.442200      -1.835100     -0.1747000    
 H    5.607100     -0.8756000       1.317300    


%chk=000103650-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103650

0 1
O -1.119415 2.894803 -0.246706
O 3.698767 -1.779473 0.503152
O 4.933024 0.094828 -0.343573
N -0.677171 0.537045 0.009739
N -3.844691 2.257422 0.263378
C -1.520201 -0.659489 0.281567
C -1.531608 -1.710448 -0.865349
C -2.918634 -0.089519 0.458664
C -4.069850 -1.040211 0.640813
C -2.623813 -2.772966 -0.583591
C -4.032330 -2.141229 -0.463982
C -2.880309 1.268595 0.265048
C -1.476654 1.697266 -0.019594
C 0.742894 0.484190 -0.096743
C 1.430712 -0.703866 0.312540
C 1.477129 1.600284 -0.591503
C 2.818568 -0.706670 0.198072
C 2.891650 1.564559 -0.693649
C 3.542905 0.397083 -0.293244
C 5.061365 -1.189961 0.387839
H -1.173451 -1.148726 1.217732
H -0.541785 -2.189994 -0.976953
H -1.753487 -1.183884 -1.813949
H -4.013137 -1.537540 1.632927
H -5.039705 -0.507903 0.610505
H -2.380938 -3.313102 0.355750
H -2.617361 -3.528356 -1.391941
H -4.783819 -2.922948 -0.240767
H -4.308286 -1.685544 -1.435396
H -4.814234 2.073990 0.496834
H -3.531708 3.211957 0.088739
H 0.909886 -1.572332 0.718981
H 0.933939 2.503505 -0.873265
H 3.446379 2.424701 -1.076586
H 5.698068 -1.873258 -0.193976
H 5.451699 -0.992110 1.405085


