%chk=000122170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122170

0 1
 O    2.585100      0.9436000       1.122800    
 O    4.672100     -0.2661000      -1.542200    
 O    5.300700       1.836200      6.1200000E-02
 O   0.8216000       3.120500       1.007300    
 N    2.238000      -1.239700      0.2607000    
 N    1.483900      -3.334300      0.1121000    
 N   0.1316000     -3.3100002E-02  0.1631000    
 N   -1.759300      -1.562500     -4.1299999E-02
 N   -2.067200      0.7581000      4.2399999E-02
 N   -1.486900      -3.938500     -0.1269000    
 C    3.611600      0.4611000     -0.9562000    
 C    3.185200     -0.1333000      0.3775000    
 C    4.009400       1.865500     -0.5470000    
 C    2.971000       2.200100      0.5191000    
 C    1.724500       2.860500     -5.3100001E-02
 C   0.8772000      -1.148300      0.1670000    
 C    2.552800      -2.573500      0.2227000    
 C   0.4295000      -2.456600      7.6300003E-02
 C  -0.9447000      -2.645100     -3.0800000E-02
 C   -1.179100     -0.3419000      5.4900002E-02
 C   -3.467200      0.8483000     -5.2800000E-02
 C   -4.059400       1.964400     -0.6488000    
 C   -4.272300     -0.1779000      0.4474000    
 C   -5.448200       2.053900     -0.7441000    
 C   -5.661000     -8.8600002E-02  0.3521000    
 C   -6.248900       1.027300     -0.2436000    
 H    2.775100      0.4929000      -1.663900    
 H    4.037200     -0.5109000      0.9567000    
 H    4.049400       2.567400      -1.384800    
 H    3.384400       2.819300       1.323200    
 H    1.215400       2.230500     -0.7877000    
 H    1.973700       3.813300     -0.5298000    
 H    5.427000     -0.2431000     -0.9297000    
 H    5.504200       2.741300      0.3529000    
 H    3.573100      -2.927700      0.2779000    
 H   0.6011000       2.267600       1.419400    
 H   -1.581300       1.647900     -1.9600000E-02
 H  -0.8814000      -4.748100     -0.1188000    
 H   -2.488900      -4.048900     -0.2029000    
 H   -3.447000       2.771300      -1.043600    
 H   -3.863600      -1.041700      0.9611000    
 H   -5.906000       2.922800      -1.207500    
 H   -6.285600     -0.8825000      0.7514000    
 H   -7.330300       1.097900     -0.3154000    


%chk=000122170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122170

0 1
O 2.716858 1.027653 1.206934
O 4.828420 -0.264426 -1.492368
O 5.333554 1.944277 -0.165107
O 0.423962 2.478026 0.618530
N 2.306826 -1.212548 0.462355
N 1.585891 -3.396476 0.383933
N 0.080165 -0.090058 0.301965
N -1.773257 -1.687183 0.092064
N -2.078328 0.695695 0.078776
N -1.416986 -4.015994 0.128967
C 3.682380 0.423267 -0.940705
C 3.276191 -0.105892 0.476863
C 3.946009 1.929637 -0.662891
C 2.893873 2.280208 0.402812
C 1.548764 2.722557 -0.253380
C 0.912291 -1.159565 0.345130
C 2.648879 -2.585954 0.484982
C 0.492000 -2.515091 0.296202
C -0.909678 -2.746777 0.173163
C -1.258499 -0.418455 0.155995
C -3.484284 0.823788 -0.042171
C -3.997158 2.152707 -0.071665
C -4.385191 -0.271478 -0.136876
C -5.381133 2.381281 -0.194703
C -5.769656 -0.023983 -0.258946
C -6.281290 1.293370 -0.290108
H 2.854002 0.286675 -1.654237
H 4.183131 -0.477670 0.992284
H 3.852523 2.552268 -1.573842
H 3.233646 3.041374 1.126954
H 1.417764 2.196400 -1.228805
H 1.592114 3.808736 -0.456915
H 5.634189 0.180196 -1.107464
H 5.611824 2.858945 0.081062
H 3.683964 -2.911064 0.559183
H 0.369160 1.436298 0.674179
H -1.550617 1.580764 0.132640
H -0.782833 -4.810325 0.188323
H -2.421433 -4.152521 0.041268
H -3.305539 3.001168 0.007195
H -3.986033 -1.285756 -0.112772
H -5.756482 3.410597 -0.213934
H -6.455729 -0.876151 -0.330630
H -7.357755 1.470878 -0.385537


