%chk=000034515.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034515

0 1
 O  -0.4690000      0.1288000      8.3899997E-02
 O   -5.294500      -2.293700      1.2000000E-02
 O   0.9855000     -0.1989000       1.818200    
 N   -3.285500     -0.2858000     -0.1728000    
 N    1.697300     -0.1586000     -0.4116000    
 C   -2.725200       1.021400      0.1633000    
 C   -1.385600      0.8589000      0.9001000    
 C   -2.572100       1.879400      -1.100500    
 C  -0.7792000       2.227200       1.226900    
 C   -1.958300       3.239700     -0.7708000    
 C  -0.6366000       3.102500     -1.9700000E-02
 C   -3.435600      -1.114500       1.031400    
 C   -4.582400     -0.1396000     -0.8482000    
 C   -4.032500      -2.468000      0.6571000    
 C   -5.153100      -1.516000      -1.177500    
 C   0.7768000     -8.9400001E-02  0.6161000    
 C    3.091700     -0.3702000     -0.3184000    
 C    3.941500      0.7200000     -0.1960000    
 C    3.589900      -1.665000     -0.3513000    
 C    5.317700      0.5113000     -0.1046000    
 C    4.965900      -1.873900     -0.2598000    
 C    3.423300       2.121400     -0.1588000    
 C    2.690000      -2.851100     -0.4823000    
 C    5.829900     -0.7857000     -0.1366000    
 H   -3.413400       1.549200      0.8407000    
 H   -1.512400      0.3458000       1.859200    
 H   -3.534000       2.098700      -1.573400    
 H   -1.949400       1.367400      -1.845200    
 H   0.1992000       2.151700       1.711000    
 H   -1.434300       2.741500       1.942200    
 H   -2.662900       3.818900     -0.1610000    
 H   -1.798000       3.806000      -1.695300    
 H   0.1200000       2.676100     -0.6890000    
 H  -0.2769000       4.096200      0.2707000    
 H   -4.081900     -0.6172000       1.766000    
 H   -2.478200      -1.346000       1.504800    
 H   -4.497800      0.3762000      -1.807900    
 H   -5.289700      0.4098000     -0.2138000    
 H   -3.362900      -3.039500      2.4999999E-03
 H   -4.201000      -3.064400       1.559700    
 H   -6.146700      -1.411100      -1.625200    
 H   -4.522000      -2.055800      -1.894200    
 H    1.341700     -3.6400001E-02  -1.356400    
 H    6.005200       1.347300     -7.4000000E-03
 H    5.382200      -2.877700     -0.2821000    
 H    2.816400       2.280500      0.7384000    
 H    4.235500       2.856300     -0.1407000    
 H    2.818600       2.332100      -1.047200    
 H    2.052700      -2.946000      0.4029000    
 H    2.060300      -2.760900      -1.373800    
 H    3.256400      -3.783600     -0.5817000    
 H    6.901400     -0.9484000     -6.4999998E-02


%chk=000034515-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034515

0 1
O -0.181248 1.798447 -0.054799
O -2.785827 -2.963529 0.853581
O 0.684570 0.388298 1.638474
N -2.339710 -0.128234 0.286182
N 1.534913 0.418489 -0.567089
C -2.598870 1.342247 0.223785
C -1.370318 2.118677 0.785707
C -2.938810 1.850947 -1.198715
C -1.561443 3.643008 0.740277
C -3.152665 3.384719 -1.218570
C -1.920932 4.142455 -0.675765
C -2.389797 -0.652586 1.681294
C -3.196844 -0.972908 -0.587205
C -1.942106 -2.120466 1.720190
C -2.736579 -2.439678 -0.516262
C 0.681700 0.803445 0.452493
C 2.580971 -0.560125 -0.459694
C 3.633907 -0.401889 0.487313
C 2.550797 -1.662161 -1.366166
C 4.643399 -1.396445 0.528121
C 3.589256 -2.620073 -1.303377
C 3.705372 0.793466 1.414703
C 1.415633 -1.810949 -2.364370
C 4.627945 -2.496078 -0.354897
H -3.464219 1.613934 0.888758
H -1.135340 1.794760 1.815231
H -3.856004 1.359593 -1.570839
H -2.109958 1.580850 -1.881895
H -0.639883 4.128638 1.110033
H -2.375085 3.906030 1.447030
H -4.040169 3.638114 -0.601478
H -3.379977 3.709824 -2.251883
H -1.057515 3.976445 -1.348066
H -2.115730 5.231519 -0.654308
H -3.424057 -0.567914 2.101055
H -1.699055 -0.076052 2.318589
H -3.110629 -0.639127 -1.635273
H -4.275520 -0.917148 -0.291545
H -0.881191 -2.188727 1.400034
H -2.049993 -2.539626 2.734027
H -3.404113 -3.088651 -1.108081
H -1.697614 -2.516456 -0.908872
H 1.266444 0.745947 -1.497412
H 5.457498 -1.290702 1.254688
H 3.571881 -3.473120 -1.991785
H 2.970330 0.697139 2.234330
H 4.713771 0.891017 1.851471
H 3.463848 1.731258 0.880600
H 0.431203 -1.715797 -1.868084
H 1.454405 -1.040834 -3.161716
H 1.458835 -2.794150 -2.861943
H 5.422523 -3.248943 -0.308979


