%chk=000150462.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150462

0 1
 O   -4.428600       2.935000      0.2486000    
 O   -2.885800      -2.856700     -0.2450000    
 O   -1.947200       2.381900      0.2288000    
 O   0.5656000       2.004300      0.2187000    
 O    3.892100      -1.779100     -8.1500001E-02
 N    7.506900      0.3986000      0.1334000    
 N    2.648100      0.2111000      8.1900001E-02
 C   -3.815400     -0.6841000     -6.3900001E-02
 C   -3.559600      0.6832000      5.9799999E-02
 C   -5.136200      -1.145300     -0.1185000    
 C   -1.056700      0.2165000      4.4500001E-02
 C   -1.312500      -1.150800     -7.9099998E-02
 C   -6.194700     -0.2389000     -4.9400002E-02
 C   -2.701100      -1.651100     -0.1375000    
 C   -5.939500       1.125500      7.4100003E-02
 C   -2.171000       1.183300      0.1183000    
 C   -4.624700       1.589200      0.1288000    
 C    6.352000     -0.4874000      5.7100002E-02
 C   0.2640000      0.6777000      9.8800004E-02
 C    1.322300     -0.2285000      2.9600000E-02
 C    5.059100      0.3200000      0.1157000    
 C  -0.2474000      -2.056900     -0.1485000    
 C   -5.485800      -2.596500     -0.2522000    
 C    7.503100       1.348100     -0.9812000    
 C    8.750600     -0.3738000      0.1373000    
 C    1.067300      -1.592900     -9.3800001E-02
 C   -7.610000     -0.7245000     -0.1079000    
 C   -7.075800       2.097000      0.1482000    
 C    3.819000     -0.5594000      2.5300000E-02
 C    8.665400       2.321000     -0.8775000    
 C    8.776500      -1.366700       1.287000    
 H    6.316700      -1.175600      0.9084000    
 H    6.376100      -1.100300     -0.8540000    
 H    4.958300       1.008200     -0.7290000    
 H    5.006600      0.8994000       1.045600    
 H  -0.4188000      -3.125700     -0.2448000    
 H   -5.134600      -3.152400      0.6241000    
 H   -6.547100      -2.832400     -0.3407000    
 H   -5.044600      -3.007900      -1.167000    
 H    7.524200      0.8422000      -1.954500    
 H    6.618700       1.989400     -0.9583000    
 H    8.906700     -0.9044000     -0.8104000    
 H    9.611800      0.2835000      0.2952000    
 H    1.826700      -2.358800     -0.1538000    
 H   -7.793000      -1.469700      0.6749000    
 H   -8.368200      4.0700000E-02  6.9799997E-02
 H   -7.826300      -1.152800      -1.092700    
 H   -7.594900       2.004300       1.107900    
 H   -6.778600       3.143400      3.6499999E-02
 H   -7.781800       1.932100     -0.6737000    
 H    2.763300       1.218400      0.1728000    
 H    8.747300       2.751400      0.1266000    
 H    9.621200       1.861400      -1.147200    
 H    8.512700       3.151600      -1.576200    
 H    8.482100     -0.9022000       2.234500    
 H    8.141800      -2.239100       1.102500    
 H    9.795700      -1.748800       1.416300    
 H   -5.017700       3.274000      0.9439000    
 H  -0.2369000       2.545100      0.2458000    


%chk=000150462-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150462

0 1
O -4.217344 2.945612 0.014360
O -3.060354 -3.064268 0.263622
O -1.722213 2.288958 0.136410
O 0.685214 1.736408 0.191979
O 3.959927 -1.983858 0.306004
N 7.541858 0.395427 -0.168323
N 2.662663 -0.033725 0.257941
C -3.873127 -0.773178 0.032524
C -3.511649 0.627128 0.059125
C -5.242842 -1.166539 -0.075719
C -1.052403 0.008600 0.151145
C -1.375280 -1.378693 0.162278
C -6.272455 -0.159730 -0.078482
C -2.792312 -1.820028 0.148806
C -5.932088 1.216213 -0.066835
C -2.094548 1.039873 0.121115
C -4.554981 1.594857 -0.003072
C 6.293903 -0.367043 -0.417435
C 0.313159 0.410806 0.186491
C 1.360384 -0.566939 0.223065
C 5.111068 0.184152 0.412777
C -0.335861 -2.332808 0.202445
C -5.657444 -2.622541 -0.217385
C 7.607819 1.661468 -0.949227
C 8.765463 -0.440675 -0.318407
C 1.021641 -1.941275 0.227637
C -7.731330 -0.594935 -0.070387
C -6.953168 2.341778 -0.149019
C 3.879900 -0.718588 0.314555
C 8.504904 2.728169 -0.292192
C 8.988607 -1.392439 0.872100
H 6.441235 -1.418352 -0.118886
H 6.019060 -0.380540 -1.501230
H 4.868229 1.223530 0.120618
H 5.438833 0.215811 1.469978
H -0.608489 -3.391741 0.215612
H -5.559181 -3.170265 0.737764
H -6.694841 -2.714296 -0.571670
H -4.996919 -3.158339 -0.916164
H 7.947819 1.474082 -1.999913
H 6.581332 2.066908 -1.025072
H 8.744236 -1.025112 -1.273274
H 9.632084 0.241622 -0.389681
H 1.826829 -2.677360 0.254007
H -7.888718 -1.428783 0.634110
H -8.410266 0.214144 0.235096
H -8.059234 -0.946478 -1.067898
H -6.986811 2.943463 0.782536
H -6.730018 3.027731 -0.992685
H -7.972736 1.975982 -0.326835
H 2.681295 0.993651 0.256382
H 8.133535 2.965695 0.719848
H 9.550723 2.384692 -0.196537
H 8.511271 3.654969 -0.896132
H 9.073877 -0.814162 1.808586
H 8.155885 -2.109034 0.989433
H 9.916167 -1.978133 0.729721
H -5.032793 3.508565 -0.025102
H -0.232116 2.274365 0.171891


