%chk=000115462.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115462

0 1
 Cl   6.839600      -3.676900     -0.6980000    
 N   -1.282800     -4.9699999E-02   1.082600    
 N   -4.008200     -0.1808000      0.2374000    
 N   -5.640400      -1.177600      -1.147500    
 N   -6.282200      0.3235000      0.6250000    
 C   3.7999999E-02  0.5578000       1.241000    
 C   -2.306900      0.7632000       1.750300    
 C   -1.613500     -0.1997000     -0.3396000    
 C    1.112500     -0.3422000      0.6201000    
 C   -3.685700      0.1081000       1.640500    
 C   -2.969900     -0.8861000     -0.5200000    
 C    2.540300      0.2447000      0.7725000    
 C    3.631700     -0.7504000      0.3989000    
 C    2.732200       1.574700      4.9699999E-02
 C   -5.354000     -0.3503000     -0.1064000    
 C    4.856200     -0.6623000       1.027400    
 C    3.360700      -1.708200     -0.5556000    
 C    3.633900       2.483000      0.5607000    
 C    1.997300       1.822800      -1.089200    
 C    5.855200      -1.573700      0.6858000    
 C    4.359700      -2.619800     -0.8972000    
 C    3.809400       3.698900     -9.9900000E-02
 C    2.172800       3.038800      -1.749700    
 C    5.607100      -2.552500     -0.2766000    
 C    3.078800       3.976800      -1.255200    
 C   -6.947400      -1.318600      -1.451300    
 C   -7.569400      0.1365000      0.2669000    
 C   -7.965200     -0.6801000     -0.7727000    
 H   5.0500002E-02   1.563400      0.8064000    
 H   0.2606000      0.6688000       2.309900    
 H   -2.344600       1.772200       1.317600    
 H   -2.064500      0.8731000       2.814400    
 H  -0.9124000     -0.8430000     -0.8749000    
 H   -1.622400      0.7761000     -0.8437000    
 H   0.9143000     -0.5489000     -0.4295000    
 H    1.075100      -1.314800       1.132600    
 H   -3.711500     -0.8245000       2.218500    
 H   -4.409800      0.7956000       2.092900    
 H   -3.198400     -0.8880000      -1.592900    
 H   -2.918000      -1.930500     -0.1867000    
 H    2.648200      0.4414000       1.850900    
 H    5.060200      8.4399998E-02   1.787900    
 H    2.416900      -1.787300      -1.080800    
 H    4.199100       2.287100       1.466000    
 H    1.302300       1.118200      -1.528100    
 H    6.821500      -1.511300       1.179800    
 H    4.154300      -3.374400      -1.652200    
 H    4.512800       4.430600      0.2868000    
 H    1.608400       3.253300      -2.652600    
 H    3.216000       4.923300      -1.769900    
 H   -7.160900      -1.981000      -2.283300    
 H   -8.298600      0.6797000      0.8585000    
 H   -9.005600     -0.8115000      -1.038000    


%chk=000115462-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115462

0 1
Cl 7.377188 -3.471364 -0.625225
N -1.321125 -0.299416 0.958405
N -4.127045 -0.688292 0.465498
N -5.733614 -0.646295 -1.265658
N -6.248155 0.218919 0.975947
C -0.009596 0.398016 1.010690
C -2.343000 0.384545 1.794551
C -1.830909 -0.476763 -0.427194
C 1.146928 -0.476593 0.484524
C -3.647948 -0.434201 1.836827
C -3.130246 -1.306173 -0.427857
C 2.543698 0.156634 0.741702
C 3.714374 -0.775194 0.377126
C 2.679168 1.518810 0.040983
C -5.399416 -0.363587 0.048920
C 5.039831 -0.348288 0.660888
C 3.540033 -2.046639 -0.223089
C 2.657172 2.723720 0.786409
C 2.805916 1.596907 -1.370529
C 6.156961 -1.155950 0.364816
C 4.646858 -2.872248 -0.533924
C 2.753489 3.978914 0.141904
C 2.898094 2.847346 -2.018773
C 5.940306 -2.413532 -0.232756
C 2.871712 4.044942 -1.264725
C -6.995817 -0.324713 -1.648642
C -7.498901 0.520504 0.541667
C -7.941740 0.267746 -0.778517
H -0.035211 1.369289 0.457253
H 0.189947 0.640971 2.073800
H -2.570951 1.412000 1.410936
H -1.948100 0.484761 2.822710
H -1.074402 -1.010205 -1.028896
H -2.025745 0.511322 -0.917922
H 1.027442 -0.655822 -0.601890
H 1.082259 -1.458115 0.991936
H -3.447132 -1.404089 2.335596
H -4.438176 0.098792 2.386488
H -3.563633 -1.368498 -1.437263
H -2.903802 -2.329263 -0.064580
H 2.613064 0.346906 1.834230
H 5.201855 0.637785 1.112180
H 2.537282 -2.416789 -0.455287
H 2.564571 2.679797 1.879259
H 2.848377 0.673053 -1.960485
H 7.171946 -0.816158 0.590429
H 4.500112 -3.852276 -0.997515
H 2.736926 4.900262 0.735210
H 2.997109 2.890298 -3.109492
H 2.947664 5.015450 -1.767654
H -7.248214 -0.552948 -2.691131
H -8.161137 0.981103 1.284510
H -8.952969 0.516516 -1.106892


