%chk=000006167.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006167

0 1
 O   0.7092000       1.962300      -1.422300    
 O    3.425600       2.144700      -1.154600    
 O    4.716200      0.8080000      0.8921000    
 O   -5.251800       1.703600      9.4499998E-02
 O   -4.554800     -0.2932000      -1.698200    
 O   0.4033000      -4.591100     -0.5559000    
 N   0.3003000      -2.266200     -0.5503000    
 C  -0.7267000      -2.119000      0.4633000    
 C  -0.1505000      -2.238600       1.892600    
 C   0.4547000     -0.9813000       2.530600    
 C   -1.548600     -0.8614000      0.1646000    
 C    1.240200     -0.1318000       1.566600    
 C   0.5748000      0.5577000      0.5311000    
 C  -0.9076000      0.4424000      0.3994000    
 C    1.320000       1.318000     -0.3839000    
 C    2.633600     -3.6300000E-02   1.675600    
 C   -2.770500      -1.039000     -0.3706000    
 C   -1.563600       1.599400      0.6113000    
 C    2.706700       1.405100     -0.2621000    
 C    3.361500      0.7310000      0.7664000    
 C   -3.782900     -3.6400001E-02 -0.7760000    
 C   0.7730000      -3.494900     -0.9686000    
 C   -2.979900       1.851100      0.6480000    
 C   -3.963300       1.197100      2.4300000E-02
 C    1.815800      -3.362500      -2.046000    
 C   0.5755000       1.237200      -2.641100    
 C    3.643700       3.515700     -0.8306000    
 C    5.487500     -0.1739000      0.2032000    
 C   -5.941300       1.152300       1.196500    
 H   -1.372300      -3.001400      0.3491000    
 H   0.6126000      -3.028500       1.901900    
 H  -0.9473000      -2.588800       2.562500    
 H  -0.3396000     -0.3689000       2.977600    
 H    1.085600      -1.283300       3.376300    
 H   0.6816000      -1.437200     -0.9951000    
 H    3.155600     -0.5659000       2.469200    
 H   -3.099000      -2.054600     -0.5905000    
 H  -0.9919000       2.501900      0.8352000    
 H   -3.242300       2.755100       1.197500    
 H    2.593600      -2.659200      -1.733700    
 H    1.347400      -3.002900      -2.966300    
 H    2.277900      -4.335500      -2.234000    
 H  -8.6499996E-02  0.3762000      -2.510500    
 H    1.552400      0.9049000      -3.006700    
 H   0.1339000       1.903200      -3.387500    
 H    4.224800       3.969900      -1.637700    
 H    2.691000       4.047700     -0.7439000    
 H    4.210200       3.606100      0.1016000    
 H    6.545500      2.5800001E-02  0.3938000    
 H    5.248500      -1.176700      0.5712000    
 H    5.309400     -0.1173000     -0.8754000    
 H   -6.022100      6.2700003E-02   1.112900    
 H   -5.462200       1.421300       2.144500    
 H   -6.955200       1.563700       1.205400    


%chk=000006167-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006167

0 1
O 0.857068 1.851677 -1.330632
O 3.660088 2.003158 -1.054941
O 4.920074 0.618714 1.181645
O -5.155558 1.866198 0.334485
O -5.138870 -0.944425 -0.172348
O -0.704044 -4.127891 -1.469231
N 0.393316 -2.374662 -0.390651
C -0.626181 -2.237240 0.671452
C -0.019134 -2.383546 2.100632
C 0.533849 -1.066078 2.713393
C -1.479349 -0.953744 0.518956
C 1.355368 -0.262098 1.721934
C 0.688259 0.396621 0.639097
C -0.806961 0.333670 0.503971
C 1.483930 1.140285 -0.280424
C 2.758960 -0.192553 1.836623
C -2.849234 -1.189637 0.384526
C -1.463375 1.572180 0.397645
C 2.897927 1.236210 -0.141597
C 3.544805 0.541886 0.917373
C -4.037495 -0.364100 0.165392
C 0.272515 -3.320813 -1.400630
C -2.841025 1.910636 0.351316
C -3.992004 1.113750 0.324226
C 1.404820 -3.328293 -2.425492
C 1.087498 1.284740 -2.681129
C 3.459754 3.469547 -0.926293
C 5.855909 0.359914 0.063312
C -6.482373 1.298319 0.683088
H -1.287849 -3.104313 0.501151
H 0.779126 -3.147712 2.045197
H -0.803213 -2.779724 2.773840
H -0.320572 -0.453062 3.058976
H 1.138469 -1.309736 3.605343
H 1.200760 -1.750694 -0.376517
H 3.275722 -0.697191 2.659075
H -3.145051 -2.248253 0.351528
H -0.800897 2.444668 0.394263
H -3.061876 2.986040 0.358811
H 2.173872 -2.557516 -2.241009
H 0.977216 -3.177564 -3.431804
H 1.886035 -4.321594 -2.422830
H 0.649954 0.270343 -2.744272
H 2.168224 1.259143 -2.909293
H 0.563872 1.959133 -3.375153
H 4.107341 3.921600 -1.692951
H 2.402641 3.727516 -1.112360
H 3.769065 3.806946 0.080088
H 6.857391 0.516063 0.491491
H 5.753446 -0.688432 -0.277573
H 5.671947 1.051368 -0.774234
H -6.806780 0.572878 -0.074564
H -6.440458 0.802284 1.668558
H -7.135220 2.183685 0.725844


