%chk=000284811.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284811

0 1
S 0.092522 4.438275 -1.017301
S -0.089006 4.438290 1.021910
N 3.421299 2.101358 -1.442956
N -3.418919 2.102750 1.445991
N 3.044876 0.921463 -0.876505
N -3.043693 0.923350 0.877743
C 2.560167 3.232658 -0.932067
C -2.557354 3.234082 0.935930
C 1.139498 3.034346 -1.451057
C -1.137027 3.035119 1.455618
C 4.870263 2.465387 -1.504306
C -4.867583 2.467637 1.509057
C 3.271125 -1.400820 -0.318743
C -3.271816 -1.398067 0.317206
C 3.832325 -0.116932 -0.787313
C -3.831859 -0.114441 0.787869
C 4.030492 -2.572002 -0.498094
C -4.031575 -2.569078 0.496008
C 2.015364 -1.481801 0.306768
C -2.016763 -1.478942 -0.309738
C 3.536641 -3.801193 -0.056974
C -3.538800 -3.798002 0.052941
C 1.528911 -2.715091 0.746880
C -1.531387 -2.711961 -0.751789
C 2.286698 -3.876153 0.567029
C -2.289557 -3.872857 -0.572473
H 2.572759 3.289084 0.180614
H 2.987082 4.186623 -1.314629
H -2.569325 3.290864 -0.176749
H -2.984157 4.188074 1.318508
H 0.707576 2.078928 -1.083530
H 1.124195 2.955997 -2.560526
H -0.705519 2.079340 1.088538
H -1.122243 2.957107 2.565108
H 5.411205 1.719130 -2.110058
H 5.353962 2.536917 -0.518372
H 4.983167 3.431728 -2.021196
H -5.408564 1.720791 2.114045
H -5.352004 2.541052 0.523616
H -4.979412 3.433233 2.027574
H 4.900472 -0.141333 -1.037963
H -4.899820 -0.138500 1.039338
H 5.002608 -2.524806 -0.983980
H -5.003149 -2.521963 0.982984
H 1.420370 -0.578025 0.446814
H -1.421476 -0.575294 -0.449366
H 4.127429 -4.704307 -0.199171
H -4.129884 -4.700988 0.194720
H 0.553620 -2.769376 1.231861
H -0.556638 -2.766173 -1.237861
H 1.905921 -4.834793 0.912322
H -1.909619 -4.831286 -0.919276


%chk=000284811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284811

0 1
S -0.015838 4.425919 -1.134749
S 0.020612 4.423470 1.142320
N 3.487413 2.138511 -1.403342
N -3.485299 2.139556 1.406057
N 3.088914 0.965630 -0.816954
N -3.087779 0.967038 0.818303
C 2.605472 3.290238 -1.108096
C -2.601957 3.290747 1.112933
C 1.155010 2.989866 -1.518648
C -1.151903 2.987954 1.523146
C 4.858631 2.347506 -1.891942
C -4.856437 2.349287 1.894548
C 3.421469 -1.361257 -0.206450
C -3.422444 -1.358765 0.204815
C 3.882831 -0.094806 -0.792472
C -3.882775 -0.092553 0.792163
C 4.306408 -2.476703 -0.179024
C -4.308432 -2.473340 0.175845
C 2.112669 -1.520262 0.336881
C -2.113612 -1.518406 -0.338255
C 3.900182 -3.710296 0.373684
C -3.903180 -3.706706 -0.378086
C 1.709083 -2.752439 0.886576
C -1.711002 -2.750355 -0.889175
C 2.599650 -3.855474 0.909785
C -2.602601 -3.852524 -0.913898
H 2.629876 3.542742 -0.027534
H 2.982430 4.159915 -1.673053
H -2.625900 3.545184 0.032813
H -2.977975 4.159875 1.679361
H 0.791338 2.081405 -1.016120
H 1.061320 2.851447 -2.611542
H -0.789165 2.080086 1.018874
H -1.058565 2.847266 2.615779
H 5.109518 1.612102 -2.681444
H 5.611833 2.248403 -1.079580
H 4.936322 3.356882 -2.324325
H -5.108290 1.613099 2.683015
H -5.609510 2.252006 1.081847
H -4.933242 3.358178 2.328220
H 4.906485 -0.091699 -1.205521
H -4.906588 -0.088910 1.204811
H 5.317620 -2.371665 -0.593623
H -5.319682 -2.367807 0.590225
H 1.430902 -0.663596 0.319234
H -1.431039 -0.662407 -0.319416
H 4.596301 -4.556899 0.386030
H -4.600093 -4.552639 -0.391598
H 0.698048 -2.857694 1.296501
H -0.699926 -2.856114 -1.298870
H 2.281501 -4.812357 1.338300
H -2.285207 -4.809237 -1.343350


