%chk=000128596.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128596

0 1
 O    2.172100       2.107900      0.8157000    
 O   0.7314000       3.623000     -0.1090000    
 N   0.1643000       1.366500      0.1368000    
 N   -4.095100      0.4203000     -0.2880000    
 C   0.7435000      0.2432000      0.8317000    
 C    2.209800      0.6671000      0.9565000    
 C   0.4759000      -1.120200      0.2121000    
 C   -1.209400       1.384600     -0.3257000    
 C   -2.207200       1.597900      0.8109000    
 C    1.180800      -2.271100      0.9453000    
 C   -3.670900       1.658600      0.3646000    
 C   -5.481300      0.5378000     -0.7621000    
 C   -3.941100     -0.7209000      0.6251000    
 C   0.9804000       2.476400      0.2372000    
 C   -5.924800     -0.7317000      -1.491100    
 C   -4.334300      -2.031300     -5.8300000E-02
 C   -5.753300      -1.964700     -0.6113000    
 C    3.195800      8.1600003E-02 -3.0800000E-02
 C    2.697300      -2.083300       1.007900    
 C   0.6167000      -2.399600       2.362200    
 C    4.528900     -0.1140000      0.3400000    
 C    2.778300     -0.2668000      -1.318100    
 C    5.437900     -0.6539000     -0.5699000    
 C    3.687300     -0.8069000      -2.227900    
 C    5.017100      -1.000300      -1.853700    
 H   0.2940000      0.2843000       1.832600    
 H    2.547100      0.4933000       1.984900    
 H   0.6098000      -1.204600     -0.8644000    
 H  -0.6035000      -1.309000      0.3080000    
 H   -1.308900       2.211900      -1.038800    
 H   -1.407000      0.4620000     -0.8785000    
 H   -2.054300      0.8669000       1.611700    
 H   -1.974200       2.562200       1.284400    
 H   0.9600000      -3.203900      0.4110000    
 H   -4.301100       1.881900       1.235400    
 H   -3.780500       2.498100     -0.3338000    
 H   -5.564900       1.378700      -1.461400    
 H   -6.164600      0.7393000      7.3399998E-02
 H   -4.544100     -0.5822000       1.532200    
 H   -2.902900     -0.8573000      0.9381000    
 H   -5.335600     -0.8528000      -2.409000    
 H   -6.973400     -0.6371000      -1.794800    
 H   -4.255300      -2.859800      0.6549000    
 H   -3.633100      -2.244800     -0.8753000    
 H   -6.468500      -1.924000      0.2194000    
 H   -5.976700      -2.870700      -1.185200    
 H    3.073700      -1.430400       1.790900    
 H    3.186200      -2.242800      5.2200001E-02
 H    3.036300      -3.030400       1.473500    
 H  -0.4753000      -2.481900       2.348300    
 H    1.005400      -3.304100       2.843600    
 H   0.8897000      -1.552600       2.999500    
 H    4.875100      0.1624000       1.332800    
 H    1.807000      1.1100000E-02  -1.710500    
 H    6.474200     -0.8005000     -0.2801000    
 H    3.369200      -1.042600      -3.239300    
 H    5.726800      -1.412300      -2.565100    


%chk=000128596-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128596

0 1
O 2.318310 2.246496 0.681008
O 0.654623 3.696372 -0.121136
N 0.310693 1.349818 0.048641
N -3.957630 0.213208 0.030725
C 0.996102 0.223227 0.740984
C 2.483120 0.750435 0.746812
C 0.740681 -1.162011 0.102286
C -1.128556 1.392532 -0.255015
C -2.031787 1.533094 0.992788
C 0.811887 -2.368815 1.085291
C -3.525155 1.518532 0.598618
C -5.128751 0.347110 -0.875921
C -4.214261 -0.802246 1.084599
C 1.025055 2.538952 0.164421
C -5.454441 -0.996117 -1.559899
C -4.513983 -2.185071 0.469935
C -5.708591 -2.099478 -0.507935
C 3.407650 0.299079 -0.371537
C 2.164907 -2.472060 1.829401
C -0.371858 -2.384206 2.084262
C 4.606231 -0.384647 -0.053243
C 3.117318 0.575024 -1.733655
C 5.494951 -0.799992 -1.070687
C 4.003403 0.163299 -2.751122
C 5.193840 -0.529398 -2.424306
H 0.651318 0.196519 1.798674
H 2.955923 0.546130 1.720769
H 1.447885 -1.318154 -0.732101
H -0.273595 -1.160008 -0.341325
H -1.281748 2.266316 -0.914576
H -1.426274 0.491509 -0.818069
H -1.821846 0.716677 1.710866
H -1.803812 2.486931 1.506520
H 0.715868 -3.275908 0.452213
H -4.147618 1.806795 1.482675
H -3.692540 2.296863 -0.171749
H -4.891537 1.112898 -1.637907
H -6.036370 0.701446 -0.317484
H -5.080450 -0.492014 1.729410
H -3.328132 -0.865245 1.742370
H -4.598431 -1.285104 -2.200283
H -6.337456 -0.870768 -2.215638
H -4.722232 -2.910376 1.280181
H -3.615561 -2.537993 -0.074130
H -6.630601 -1.858476 0.061096
H -5.878824 -3.075319 -1.000672
H 2.307976 -1.623772 2.526742
H 3.012720 -2.481679 1.121618
H 2.208383 -3.399244 2.430266
H -1.342856 -2.365558 1.554233
H -0.343199 -3.296042 2.709175
H -0.340971 -1.516828 2.771587
H 4.852937 -0.582383 0.997680
H 2.204331 1.120828 -1.995142
H 6.420744 -1.323530 -0.807437
H 3.770583 0.386445 -3.798279
H 5.882328 -0.845594 -3.215900


