%chk=000125776.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125776

0 1
 N   -2.466000      0.4025000     -2.8200001E-02
 N    2.460200      0.3785000     -8.6000003E-03
 N   -8.679700     -0.3377000      4.4000000E-02
 N    8.680600     -0.3212000      1.1700000E-02
 C   1.1200000E-02  0.3914000     -1.7600000E-02
 C   -1.274800     -0.4379000     -1.5500000E-02
 C    1.276200     -0.4689000     -2.3300000E-02
 C   -3.674700     -0.4095000     -1.5699999E-02
 C    3.676000     -0.4263000     -5.4000001E-03
 C   -4.915200      0.4840000     -2.0300001E-02
 C    4.910100      0.4753000      2.1299999E-02
 C   -6.197400     -0.3544000      1.7000000E-03
 C    6.198200     -0.3545000      1.5900001E-02
 C   -7.476400      0.4851000      2.5900001E-02
 C    7.471700      0.4937000      1.4200000E-02
 H   1.5200000E-02   1.047900     -0.8981000    
 H   1.8800000E-02   1.045500      0.8646000    
 H   -1.272900      -1.097600     -0.8921000    
 H   -1.279100      -1.074600      0.8778000    
 H    1.274600      -1.108400     -0.9144000    
 H    1.268200      -1.120400      0.8588000    
 H   -3.699000      -1.068300     -0.8925000    
 H   -3.692100      -1.041700      0.8803000    
 H    3.690600      -1.079800      0.8753000    
 H    3.710000      -1.063300     -0.8977000    
 H   -4.899800       1.147500      0.8534000    
 H   -4.915100       1.123000     -0.9123000    
 H    4.905500       1.141500     -0.8506000    
 H    4.890200       1.111500      0.9150000    
 H   -2.457700      0.9999000     -0.8544000    
 H    2.455800      0.9940000     -0.8215000    
 H   -6.181100      -1.010200      0.8821000    
 H   -6.211000      -1.009500     -0.8790000    
 H    6.199700      -1.007000     -0.8669000    
 H    6.202800      -1.012600      0.8944000    
 H   -7.509100       1.138400     -0.8529000    
 H   -7.479300       1.133600      0.9088000    
 H    7.486600       1.143900      0.8956000    
 H    7.483800       1.145200     -0.8663000    
 H   -8.685200     -0.9504000     -0.7709000    
 H   -8.657600     -0.9548000      0.8553000    
 H    8.677700     -0.9366000      0.8244000    
 H    8.675100     -0.9355000     -0.8019000    


%chk=000125776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125776

0 1
N -2.490777 0.197234 -0.005407
N 2.491408 0.198438 -0.006092
N -8.880576 0.015262 0.006482
N 8.881253 0.017140 0.006347
C 0.000286 0.200231 0.003613
C -1.281747 -0.654089 -0.028173
C 1.282727 -0.653381 -0.028372
C -3.770283 -0.544490 -0.028947
C 3.771082 -0.542979 -0.029785
C -4.974334 0.415973 0.013741
C 4.974998 0.417712 0.011740
C -6.333986 -0.318123 -0.010871
C 6.334700 -0.316319 -0.011621
C -7.547082 0.651053 0.025560
C 7.547738 0.652923 0.024564
H -0.000020 0.890729 -0.868707
H 0.000114 0.830742 0.910549
H -1.250991 -1.337198 -0.917540
H -1.309611 -1.307281 0.867531
H 1.252085 -1.336737 -0.917595
H 1.311182 -1.306457 0.867415
H -3.865720 -1.215671 -0.922823
H -3.796812 -1.204789 0.861659
H 3.798236 -1.202738 0.861204
H 3.866195 -1.214683 -0.923316
H -4.893115 1.040815 0.924612
H -4.919863 1.112180 -0.851260
H 4.920643 1.112671 -0.854257
H 4.893521 1.043792 0.921753
H -2.459640 0.906595 -0.752867
H 2.459861 0.907492 -0.753835
H -6.399927 -1.009534 0.855610
H -6.404887 -0.948542 -0.922539
H 6.406063 -0.947466 -0.922752
H 6.400272 -1.007032 0.855444
H -7.486402 1.343695 -0.837004
H -7.482337 1.282293 0.933359
H 7.482685 1.284731 0.931948
H 7.487327 1.345023 -0.838451
H -9.082566 -0.500843 -0.856103
H -9.083190 -0.549968 0.837510
H 9.083622 -0.547469 0.837860
H 9.083470 -0.499635 -0.855785


