%chk=000067389.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067389

0 1
 O   -4.002300       1.619800       1.418300    
 O    6.673300     -0.6274000      0.1161000    
 N   -4.848200      -3.196800      -1.517900    
 C   -1.705700      0.9575000      0.7657000    
 C   -1.109900      0.7097000     -0.6389000    
 C   0.4193000      0.7701000     -0.6466000    
 C   -3.228100      0.9520000      0.4310000    
 C   0.9736000     -0.3365000      0.3002000    
 C   -1.189000     -0.1471000       1.704800    
 C   -1.887100       1.674400      -1.530900    
 C   0.3504000     -0.2258000       1.716800    
 C   -3.293600       1.744400     -0.9006000    
 C    1.006300      0.5664000      -2.045500    
 C   -1.316200       2.336700       1.376000    
 C    2.499300     -0.3809000      0.2670000    
 C    2.515500      0.7876000      -2.010300    
 C    3.207100      0.1151000     -0.8498000    
 C   -3.791300     -0.3986000      0.2372000    
 C    3.232200     -0.9931000       1.299400    
 C    4.610700      3.6400001E-02 -0.8813000    
 C    4.625800      -1.072400       1.251300    
 C   -4.248900      -1.497900      7.9800002E-02
 C    5.315800     -0.5537000      0.1635000    
 C   -4.808800      -2.839900     -0.1056000    
 H   -1.382700     -0.3050000     -0.9702000    
 H   0.7492000       1.755600     -0.2939000    
 H   0.6527000      -1.309700     -0.1029000    
 H   -1.560600      -1.130000       1.392300    
 H   -1.557700      1.1600000E-02   2.725400    
 H   -1.936100       1.319500      -2.565500    
 H   -1.427100       2.668800      -1.544600    
 H   0.7694000      0.6403000       2.242600    
 H   0.6189000      -1.102600       2.317700    
 H   -3.568100       2.793000     -0.7318000    
 H   -4.041800       1.336400      -1.591100    
 H   0.5646000       1.262000      -2.767600    
 H   0.7850000     -0.4477000      -2.402600    
 H  -0.2372000       2.463400       1.493200    
 H   -1.667700       3.178000      0.7706000    
 H   -1.755300       2.452200       2.374000    
 H    2.717300       1.864500      -1.943600    
 H    2.943100      0.4309000      -2.955100    
 H   -4.903900       1.733300       1.071100    
 H    2.734600      -1.428700       2.160600    
 H    5.149500      0.4414000      -1.735800    
 H    5.164000      -1.546000       2.068000    
 H   -5.822900      -2.887000      0.3043000    
 H   -4.207200      -3.578500      0.4339000    
 H    6.983100     -0.2193000     -0.7106000    
 H   -3.909600      -3.160300      -1.913500    
 H   -5.407900      -2.519100      -2.033900    


%chk=000067389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000067389

0 1
O -3.980489 1.561289 1.487942
O 6.804016 -0.696472 0.259946
N -5.517360 -3.112891 -1.494468
C -1.674129 0.974188 0.744925
C -1.067674 0.717987 -0.669732
C 0.469043 0.796201 -0.670528
C -3.210210 0.906243 0.399426
C 1.019660 -0.290013 0.305952
C -1.141892 -0.098838 1.721158
C -1.880161 1.649405 -1.609444
C 0.411394 -0.138999 1.730940
C -3.301276 1.717612 -0.953886
C 1.095674 0.591170 -2.065970
C -1.361951 2.392623 1.294595
C 2.556324 -0.344898 0.284290
C 2.616401 0.842324 -2.009697
C 3.297250 0.156575 -0.826238
C -3.713937 -0.470764 0.210484
C 3.281033 -0.950576 1.346642
C 4.709913 0.043462 -0.840214
C 4.683553 -1.064122 1.336986
C -4.203055 -1.592246 0.025342
C 5.401397 -0.559970 0.231224
C -4.787247 -2.938859 -0.218145
H -1.333725 -0.329123 -0.940149
H 0.780965 1.798211 -0.304567
H 0.650376 -1.265671 -0.090866
H -1.527656 -1.091533 1.413905
H -1.517493 0.091210 2.745060
H -1.919269 1.256677 -2.640590
H -1.419348 2.654467 -1.658953
H 0.824082 0.771338 2.208044
H 0.723470 -0.989129 2.366359
H -3.579171 2.755407 -0.697429
H -4.084665 1.310045 -1.616029
H 0.635676 1.275011 -2.804653
H 0.890925 -0.444162 -2.408759
H -0.288199 2.507566 1.519043
H -1.642440 3.191581 0.586593
H -1.931969 2.559667 2.223182
H 2.794532 1.935916 -1.935030
H 3.096940 0.517537 -2.953252
H -4.929540 1.290893 1.397761
H 2.739910 -1.349671 2.210405
H 5.267944 0.432748 -1.704549
H 5.228517 -1.533014 2.161388
H -5.477059 -3.189800 0.609864
H -3.980228 -3.694861 -0.178896
H 7.208414 -0.308461 -0.555292
H -4.917544 -3.003057 -2.319391
H -6.353924 -2.523220 -1.564031


