SMILES:C1[C@H]([C@@H](CC1)[NH3+])F.[Br-]	

FORMULA: C5H11BrFN
MASS: 184.0499
EXACT MASS: 183.0058896
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      F   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8250     0.0000 
   C   3    1.3361     0.8252     0.0000 
   C   4    1.3362     1.3362     0.8276     0.0000 
   C   5    0.8239     1.3327     1.3344     0.8242     0.0000 
   F   6    1.4697     0.8250     1.4699     2.1362     2.1326     0.0000 
   N   7    2.1359     1.4706     0.8249     1.4727     2.1344     1.7948 
  Br   8    3.4066     2.6233     2.1986     2.8818     3.5309     2.5383 
   H   9    1.7949     2.4211     2.3378     1.6018     1.0907     3.2076 
   H  10    1.7949     2.4211     2.3378     1.6018     1.0907     3.2076 
   H  11    1.7949     2.4211     2.3378     1.6018     1.0907     3.2076 

              N   7     Br   8      H   9      H  10      H  11
              -------------------------------------------------------
   N   7    0.0000 
  Br   8    1.4119     0.0000 
   H   9    3.0697     4.4811     0.0000 
   H  10    3.0697     4.4811     0.0000     0.0000 
   H  11    3.0697     4.4811     0.0000     0.0000     0.0000 



ATOMIC CHARGES
   C   1    0.0414690986
   C   2    0.2094022199
   C   3    0.0824911444
   C   4    0.0577309361
   C   5    0.0089901343
   F   6   -0.2311607842
   N   7    0.2301087791
  Br   8    0.0000000000
   H   9    0.2003228239
   H  10    0.2003228239
   H  11    0.2003228239


BOND ANGLES
   6    2    3    F   C3   C3    125.937
   2    3    4   C3   C3   C3    107.892
   2    3    7   C3   C3  N3+    126.051
   7    3    4  N3+   C3   C3    126.057
   3    4    5   C3   C3   C3    107.781
   3    2    6   C3   C3    F    125.937
   4    3    7   C3   C3  N3+    126.057
   3    7    9   C3  N3+   HC     23.675
   3    7   10   C3  N3+   HC     23.675
   3    7   11   C3  N3+   HC     23.675
  10    7    9   HC  N3+   HC      0.026
  11    7    9   HC  N3+   HC      0.026
   9    7   10   HC  N3+   HC      0.026
  11    7   10   HC  N3+   HC      0.026
   9    7   11   HC  N3+   HC      0.026
  10    7   11   HC  N3+   HC      0.026


TORSION ANGLES
   1    2    3    4      0.026
   1    2    3    7    179.974
   6    2    3    4    179.974
   6    2    3    7      0.026
   2    3    4    5      0.026
   7    3    4    5    179.974
   3    4    5    1      0.026
   4    5    1    2      0.026
   5    1    2    3      0.026
   5    1    2    6    179.974
   2    3    7    9    179.974
   2    3    7   10    179.974
   2    3    7   11    179.974
   4    3    7    9      0.026
   4    3    7   10      0.026
   4    3    7   11      0.026


CHIRAL ATOMS
   C     2 is chiral: counterclockwise
   C     3 is chiral: clockwise