%chk=000041500.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041500

0 1
 O  -0.8475000      -2.040100      0.1105000    
 O   -2.842600     -0.1818000       1.385600    
 N    1.307400       2.011600      0.1135000    
 N   -2.961400     -0.1269000     -0.9594000    
 C    1.553300     -0.2034000      1.0100000E-02
 C   0.1684000      0.1065000      0.1139000    
 C    2.245800       1.009500      1.2000000E-02
 C   4.8999999E-02   1.475800      0.1756000    
 C    2.286500      -1.402700     -8.5500002E-02
 C    3.640300       1.083000     -7.7399999E-02
 C  -0.9422000     -0.8022000      0.1532000    
 C    3.681900      -1.344500     -0.1754000    
 C    4.346400     -0.1197000     -0.1712000    
 C   -2.374500     -0.3300000      0.2685000    
 C   -4.323900      0.3267000      -1.112200    
 C   -4.987000      0.5381000      0.2382000    
 H  -0.8124000       2.124400      0.2586000    
 H    1.517900       2.999800      0.1386000    
 H    1.790100      -2.368500     -9.0800002E-02
 H    4.158600       2.036000     -7.4199997E-02
 H    4.252800      -2.266400     -0.2493000    
 H    5.431000     -9.7800002E-02 -0.2420000    
 H   -4.301500       1.258100      -1.686200    
 H   -4.860900     -0.4257000      -1.697700    
 H   -2.422500     -0.2990000      -1.803200    
 H   -5.078900     -0.3881000      0.8147000    
 H   -4.508500       1.328200      0.8259000    
 H   -6.014700      0.8808000      6.5399997E-02


%chk=000041500-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041500

0 1
O -0.868870 -1.130634 -1.197818
O -2.429492 1.104031 1.168294
N 1.753435 1.585466 1.536445
N -3.288580 -0.442133 -0.368523
C 1.697195 -0.001959 -0.111546
C 0.326988 0.330991 0.281707
C 2.571810 0.800812 0.692953
C 0.421441 1.310580 1.296204
C 2.257016 -0.894721 -1.058754
C 3.975735 0.745093 0.587194
C -0.882241 -0.243383 -0.272912
C 3.662035 -0.958466 -1.173235
C 4.510939 -0.151212 -0.363004
C -2.268827 0.222661 0.262453
C -4.709623 -0.196419 -0.094836
C -5.428420 0.493028 -1.275104
H -0.396947 1.793670 1.825254
H 2.094651 2.258137 2.221421
H 1.600016 -1.511244 -1.677198
H 4.629925 1.365322 1.209643
H 4.113445 -1.642722 -1.900011
H 5.597743 -0.226697 -0.478651
H -5.204280 -1.158498 0.141494
H -4.753253 0.438998 0.806763
H -2.989701 -1.114546 -1.087104
H -4.967030 1.472083 -1.490977
H -5.380783 -0.122599 -2.192091
H -6.493428 0.656059 -1.028263


